3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene

C304H495N33O — CID 158972490

About 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene

3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene (PubChem CID 158972490) has the molecular formula C304H495N33O and a molecular weight of 4628.53 g/mol. Its IUPAC name is 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene.

Molecular Properties

• Compound Name: 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene
• PubChem CID: 158972490
• Molecular Formula: C304H495N33O
• Molecular Weight: 4628.53 g/mol
• Exact Mass: 4624.97
• IUPAC Name: 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene
• SMILES: C=C1CCC2C=CCCN2C1.C=C1CCC2CC=CCN2C1.C=C1CCC2CCCCCN12.C=C1CCC2CCCCCN2C1.C=C1CCC2CCCCN12.C=C1CCC2CCCN12.C=C1CCC2CCCN2C1.C=C1CCC2CCN12.C=C1CCC2CCN2C1.C=C1CCCC2C=CCCN12.C=C1CCCC2CC=CCN12.C=C1CCCC2CCCCCN12.C=C1CCCC2CCCCN12.C=C1CCCC2CCCN12.C=C1CCCC2CCN12.C=C1CCCN2CC=CCC12.C=C1CCCN2CCC12.C=C1CCCN2CCC=CC12.C=C1CCCN2CCCC12.C=C1CCCN2CCCCC12.C=C1CCCN2CCCCCC12.C=C1CCN2CCC=CC2C1.C=C1CCN2CCCC2C1.C=C1CCN2CCCCC2C1.C=C1CCNC2CCCC12.C=C1CCNC2CCCCC12.CC1=NC2(CC2)COC1.CC1=NC2CCCCC2CC1.CC1=NCC2CC12.CC1=NCC2CCC12.CC1=NCC2CCCC12.CC1=NCC2CCCCC12.CC1=NCCCC12CCCCC2
• InChI: InChI=1S/4C11H19N.C10H17N.2C10H15N.C10H17N.4C10H15N.C10H17N.C10H15N.3C10H17N.7C9H15N.5C8H13N.C7H11NO.2C7H11N.C6H9N/c1-10-6-5-8-11-7-3-2-4-9-12(10)11;1-10-6-5-9-12-8-4-2-3-7-11(10)12;1-10-11(8-5-9-12-10)6-3-2-4-7-11;1-10-6-7-11-5-3-2-4-8-12(11)9-10;3*1-9-5-4-7-10-6-2-3-8-11(9)10;3*1-9-5-4-8-11-7-3-2-6-10(9)11;2*1-9-5-6-10-4-2-3-7-11(10)8-9;2*1-9-5-7-11-6-3-2-4-10(11)8-9;1-9-6-7-10-5-3-2-4-8-11(9)10;1-8-6-7-11-10-5-3-2-4-9(8)10;1-8-6-7-9-4-2-3-5-10(9)11-8;1-8-4-2-6-10-7-3-5-9(8)10;1-8-4-2-5-9-6-3-7-10(8)9;1-8-4-5-9-3-2-6-10(9)7-8;1-8-4-6-10-5-2-3-9(10)7-8;1-8-5-6-9-4-2-3-7-10(8)9;1-7-5-6-10-9-4-2-3-8(7)9;1-7-9-5-3-2-4-8(9)6-10-7;1-7-2-3-8-4-5-9(8)6-7;1-7-4-5-8-3-2-6-9(7)8;1-7-3-2-5-9-6-4-8(7)9;1-7-3-2-4-8-5-6-9(7)8;1-6-8-4-2-3-7(8)5-9-6;1-6-4-9-5-7(8-6)2-3-7;1-6-2-3-7-4-5-8(6)7;1-5-7-3-2-6(7)4-8-5;1-4-6-2-5(6)3-7-4/h2*11H,1-9H2;2-9H2,1H3;11H,1-9H2;10H,1-8H2;2,6,10H,1,3-5,7-8H2;2-3,10H,1,4-8H2;10H,1-8H2;2,6,10H,1,3-5,7-8H2;2-3,10H,1,4-8H2;2,4,10H,1,3,5-8H2;2-3,10H,1,4-8H2;10H,1-8H2;2,4,10H,1,3,5-8H2;10H,1-8H2;9-11H,1-7H2;9-10H,2-7H2,1H3;5*9H,1-7H2;8-10H,1-6H2;8-9H,2-6H2,1H3;4*8H,1-6H2;7-8H,2-5H2,1H3;2-5H2,1H3;7H,1-5H2;6-7H,2-4H2,1H3;5-6H,2-3H2,1H3
• InChIKey: FEBIHVFKXLJKKK-UHFFFAOYSA-N
• XLogP: 66.95
• TPSA: 197.57 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 34
• Heavy Atoms: 338
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4628.53
LogP ≤ 5	66.95
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene?

The IUPAC name of 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene (CID 158972490) is 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene.

What is the SMILES notation for 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene?

The canonical SMILES for 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene is C=C1CCC2C=CCCN2C1.C=C1CCC2CC=CCN2C1.C=C1CCC2CCCCCN12.C=C1CCC2CCCCCN2C1.C=C1CCC2CCCCN12.C=C1CCC2CCCN12.C=C1CCC2CCCN2C1.C=C1CCC2CCN12.C=C1CCC2CCN2C1.C=C1CCCC2C=CCCN12.C=C1CCCC2CC=CCN12.C=C1CCCC2CCCCCN12.C=C1CCCC2CCCCN12.C=C1CCCC2CCCN12.C=C1CCCC2CCN12.C=C1CCCN2CC=CCC12.C=C1CCCN2CCC12.C=C1CCCN2CCC=CC12.C=C1CCCN2CCCC12.C=C1CCCN2CCCCC12.C=C1CCCN2CCCCCC12.C=C1CCN2CCC=CC2C1.C=C1CCN2CCCC2C1.C=C1CCN2CCCCC2C1.C=C1CCNC2CCCC12.C=C1CCNC2CCCCC12.CC1=NC2(CC2)COC1.CC1=NC2CCCCC2CC1.CC1=NCC2CC12.CC1=NCC2CCC12.CC1=NCC2CCCC12.CC1=NCC2CCCCC12.CC1=NCCCC12CCCCC2.

What is the InChIKey of 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene?

The InChIKey is FEBIHVFKXLJKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/4C11H19N.C10H17N.2C10H15N.C10H17N.4C10H15N.C10H17N.C10H15N.3C10H17N.7C9H15N.5C8H13N.C7H11NO.2C7H11N.C6H9N/c1-10-6-5-8-11-7-3-2-4-9-12(10)11;1-10-6-5-9-12-8-4-2-3-7-11(10)12;1-10-11(8-5-9-12-10)6-3-2-4-7-11;1-10-6-7-11-5-3-2-4-8-12(11)9-10;3*1-9-5-4-7-10-6-2-3-8-11(9)10;3*1-9-5-4-8-11-7-3-2-6-10(9)11;2*1-9-5-6-10-4-2-3-7-11(10)8-9;2*1-9-5-7-11-6-3-2-4-10(11)8-9;1-9-6-7-10-5-3-2-4-8-11(9)10;1-8-6-7-11-10-5-3-2-4-9(8)10;1-8-6-7-9-4-2-3-5-10(9)11-8;1-8-4-2-6-10-7-3-5-9(8)10;1-8-4-2-5-9-6-3-7-10(8)9;1-8-4-5-9-3-2-6-10(9)7-8;1-8-4-6-10-5-2-3-9(10)7-8;1-8-5-6-9-4-2-3-7-10(8)9;1-7-5-6-10-9-4-2-3-8(7)9;1-7-9-5-3-2-4-8(9)6-10-7;1-7-2-3-8-4-5-9(8)6-7;1-7-4-5-8-3-2-6-9(7)8;1-7-3-2-5-9-6-4-8(7)9;1-7-3-2-4-8-5-6-9(7)8;1-6-8-4-2-3-7(8)5-9-6;1-6-4-9-5-7(8-6)2-3-7;1-6-2-3-7-4-5-8(6)7;1-5-7-3-2-6(7)4-8-5;1-4-6-2-5(6)3-7-4/h2*11H,1-9H2;2-9H2,1H3;11H,1-9H2;10H,1-8H2;2,6,10H,1,3-5,7-8H2;2-3,10H,1,4-8H2;10H,1-8H2;2,6,10H,1,3-5,7-8H2;2-3,10H,1,4-8H2;2,4,10H,1,3,5-8H2;2-3,10H,1,4-8H2;10H,1-8H2;2,4,10H,1,3,5-8H2;10H,1-8H2;9-11H,1-7H2;9-10H,2-7H2,1H3;5*9H,1-7H2;8-10H,1-6H2;8-9H,2-6H2,1H3;4*8H,1-6H2;7-8H,2-5H2,1H3;2-5H2,1H3;7H,1-5H2;6-7H,2-4H2,1H3;5-6H,2-3H2,1H3.

What are the key properties of 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene?

3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene has a molecular weight of 4628.53 g/mol, XLogP of 66.95, 0 rotatable bonds, 2 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methyl-1,3a,4,5,6,6a-hexahydrocyclopenta[c]pyrrole;3-methyl-3a,4,5,6,7,7a-hexahydro-1H-isoindole;2-methyl-3,4,4a,5,6,7,8,8a-octahydroquinoline;2-methyl-3-azabicyclo[3.2.0]hept-2-ene;2-methyl-3-azabicyclo[3.1.0]hex-2-ene;1-methyl-2-azaspiro[5.5]undec-1-ene;4-methylidene-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[b]pyridine;4-methylidene-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoline;3-methylidene-2,5,6,7,8,8a-hexahydro-1H-indolizine;5-methylidene-2,3,6,7,8,8a-hexahydro-1H-indolizine;6-methylidene-2,3,5,7,8,8a-hexahydro-1H-indolizine;7-methylidene-2,3,5,6,8,8a-hexahydro-1H-indolizine;8-methylidene-2,3,5,6,7,8a-hexahydro-1H-indolizine;1-methylidene-2,3,4,6,7,9a-hexahydroquinolizine;2-methylidene-1,3,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,7,9a-hexahydroquinolizine;3-methylidene-1,2,4,6,9,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,7,9a-hexahydroquinolizine;4-methylidene-1,2,3,6,9,9a-hexahydroquinolizine;9-methylidene-1,4,6,7,8,9a-hexahydroquinolizine;1-methylidene-3,4,6,7,8,9,10,10a-octahydro-2H-pyrido[1,2-a]azepine;3-methylidene-2,4,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;4-methylidene-2,3,6,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a]azepine;3-methylidene-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepine;6-methylidene-1,2,3,4,7,8,9,9a-octahydroquinolizine;8-methylidene-1,2,3,4,6,7,9,9a-octahydroquinolizine;9-methylidene-1,2,3,4,6,7,8,9a-octahydroquinolizine;2-methylidene-1-azabicyclo[3.2.0]heptane;2-methylidene-1-azabicyclo[4.2.0]octane;3-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1-azabicyclo[4.2.0]octane;5-methylidene-1,2,3,6,7,8-hexahydropyrrolizine;5-methyl-7-oxa-4-azaspiro[2.5]oct-4-ene is sourced from PubChem (CID 158972490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).