1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]

C16H23N — CID 142805166

IUPAC1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]
SMILESC=C1CC2(CCC(C)CC2)C2=C1C=CCN2C
InChIInChI=1S/C16H23N/c1-12-6-8-16(9-7-12)11-13(2)14-5-4-10-17(3)15(14)16/h4-5,12H,2,6-11H2,1,3H3
InChIKeySIQBZXHUENIBPO-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.90
Rot. Bonds

About 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]

1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] (PubChem CID 142805166) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane].

Molecular Properties

Compound Name1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]
PubChem CID142805166
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]
SMILESC=C1CC2(CCC(C)CC2)C2=C1C=CCN2C
InChIInChI=1S/C16H23N/c1-12-6-8-16(9-7-12)11-13(2)14-5-4-10-17(3)15(14)16/h4-5,12H,2,6-11H2,1,3H3
InChIKeySIQBZXHUENIBPO-UHFFFAOYSA-N
XLogP3.90
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] with MolForge

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Related Compounds

N-[3-ethenyl-2-(3-fluoropentyl)-3-propylheptyl]-4-ethyl-N,3,5-trimethylcyclohexa-1,2,5-trien-1-amine
CID 123490671
2-(2-Fluoro-6-methylcyclohexa-1,5-dien-1-yl)-7-propan-2-yl-2-azaspiro[3.5]nonane
CID 176552689
2-(2-Fluoro-6-methylcyclohexa-1,5-dien-1-yl)-7-methyl-2-azaspiro[3.5]nonane
CID 176552888
7-Ethyl-2-(2-fluoro-6-methylcyclohexa-1,5-dien-1-yl)-2-azaspiro[3.5]nonane
CID 176552968
7,7-Diethyl-15,15-difluoro-6-methylidene-5-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,8,10,13-pentaene
CID 162582251
N-(1,2,3,4,5,8,9,9a-octahydrofluoren-4a-ylmethyl)-N-methylethanamine
CID 57185905
(2S)-1-[(2E)-2-ethylidene-1,3,3-trimethyl-4,5-dihydro-1H-inden-5-yl]-2-pent-4-enyl-2,3,4,5-tetrahydroindole
CID 68307479
6-Pentyl-1,2,3,5,6,6a-hexahydropyrrolo[2,1-a]isoquinoline
CID 70359979
5-Ethyl-1-(3-ethylcyclohexyl)-5,6-dihydroindole
CID 70849848
(2E)-2-ethylidene-3,3,5-trimethyl-1-propyl-4,5-dihydroindole
CID 71108314
9-(4-Hexylcyclohexa-1,3-dien-1-yl)-3,4,4b,8a-tetrahydrocarbazole
CID 71134578
1,3,3-trimethyl-4,5-dihydro-2H-indole
CID 89257158

Frequently Asked Questions

What is the IUPAC name of 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]?
The IUPAC name of 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] (CID 142805166) is 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane].
What is the SMILES notation for 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]?
The canonical SMILES for 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] is C=C1CC2(CCC(C)CC2)C2=C1C=CCN2C.
What is the InChIKey of 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]?
The InChIKey is SIQBZXHUENIBPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-12-6-8-16(9-7-12)11-13(2)14-5-4-10-17(3)15(14)16/h4-5,12H,2,6-11H2,1,3H3.
What are the key properties of 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane]?
1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] has a molecular weight of 229.37 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4'-dimethyl-5-methylidenespiro[2,6-dihydrocyclopenta[b]pyridine-7,1'-cyclohexane] is sourced from PubChem (CID 142805166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).