N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine

C159H331N27 — CID 157497547

IUPACN-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
SMILESCC(C)CC1CCCNC1.CC(C)CC1CCN(C)CC1.CC(C)N1CC2(CCCCN2)C1.CC(C)N1CC2CCCC21.CC(C)N1CC2CCN(C)C2C1.CC(C)N1CCC(N(C)C)C1.CC(C)N1CCC(N2CCCCC2)C1.CC(C)N1CCC2(CCCCN2)CC1.CC(C)N1CCC2(CCNC2)CC1.CC(C)N1CCC2CCCC21.CC(C)N1CCCCC1.CC(C)NCC1CCN1.CC(C)NCCC1CCC1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CCN1.CNC1CCN(C(C)C)C1.CNC1CN(C(C)C)C1
InChIInChI=1S/2C12H24N2.C11H22N2.2C10H20N2.C10H19N.C10H21N.2C9H20N2.C9H17N.3C9H19N.C8H18N2.C8H17N.2C7H16N2/c1-11(2)14-9-6-12(7-10-14)5-3-4-8-13-12;1-11(2)14-9-6-12(10-14)13-7-4-3-5-8-13;1-10(2)13-7-4-11(5-8-13)3-6-12-9-11;1-8(2)12-6-9-4-5-11(3)10(9)7-12;1-9(2)12-7-10(8-12)5-3-4-6-11-10;1-8(2)11-7-6-9-4-3-5-10(9)11;1-9(2)8-10-4-6-11(3)7-5-10;1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)11-6-4-9(3)10-5-7-11;1-7(2)10-6-8-4-3-5-9(8)10;1-8(2)10-6-4-9(3)5-7-10;1-8(2)6-9-4-3-5-10-7-9;1-8(2)10-7-6-9-4-3-5-9;1-7(2)10-5-4-8(6-10)9-3;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-7(5-9)8-3;1-6(2)9-5-7-3-4-8-7/h11,13H,3-10H2,1-2H3;11-12H,3-10H2,1-2H3;10,12H,3-9H2,1-2H3;8-10H,4-7H2,1-3H3;9,11H,3-8H2,1-2H3;8-10H,3-7H2,1-2H3;9-10H,4-8H2,1-3H3;8-9H,5-7H2,1-4H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;8-9H,4-7H2,1-3H3;2*8-10H,3-7H2,1-2H3;7-9H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6-8H,4-5H2,1-3H3;6-9H,3-5H2,1-2H3
InChIKeyBXZYUIWGTLOQOK-UHFFFAOYSA-N
MW2621.59 g/mol
LogP25.86
Rot. Bonds28

About N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine

N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine (PubChem CID 157497547) has the molecular formula C159H331N27 and a molecular weight of 2621.59 g/mol. Its IUPAC name is N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine.

Molecular Properties

Compound NameN-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
PubChem CID157497547
Molecular FormulaC159H331N27
Molecular Weight2621.59 g/mol
Exact Mass2619.67
IUPAC NameN-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine
SMILESCC(C)CC1CCCNC1.CC(C)CC1CCN(C)CC1.CC(C)N1CC2(CCCCN2)C1.CC(C)N1CC2CCCC21.CC(C)N1CC2CCN(C)C2C1.CC(C)N1CCC(N(C)C)C1.CC(C)N1CCC(N2CCCCC2)C1.CC(C)N1CCC2(CCCCN2)CC1.CC(C)N1CCC2(CCNC2)CC1.CC(C)N1CCC2CCCC21.CC(C)N1CCCCC1.CC(C)NCC1CCN1.CC(C)NCCC1CCC1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CCN1.CNC1CCN(C(C)C)C1.CNC1CN(C(C)C)C1
InChIInChI=1S/2C12H24N2.C11H22N2.2C10H20N2.C10H19N.C10H21N.2C9H20N2.C9H17N.3C9H19N.C8H18N2.C8H17N.2C7H16N2/c1-11(2)14-9-6-12(7-10-14)5-3-4-8-13-12;1-11(2)14-9-6-12(10-14)13-7-4-3-5-8-13;1-10(2)13-7-4-11(5-8-13)3-6-12-9-11;1-8(2)12-6-9-4-5-11(3)10(9)7-12;1-9(2)12-7-10(8-12)5-3-4-6-11-10;1-8(2)11-7-6-9-4-3-5-10(9)11;1-9(2)8-10-4-6-11(3)7-5-10;1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)11-6-4-9(3)10-5-7-11;1-7(2)10-6-8-4-3-5-9(8)10;1-8(2)10-6-4-9(3)5-7-10;1-8(2)6-9-4-3-5-10-7-9;1-8(2)10-7-6-9-4-3-5-9;1-7(2)10-5-4-8(6-10)9-3;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-7(5-9)8-3;1-6(2)9-5-7-3-4-8-7/h11,13H,3-10H2,1-2H3;11-12H,3-10H2,1-2H3;10,12H,3-9H2,1-2H3;8-10H,4-7H2,1-3H3;9,11H,3-8H2,1-2H3;8-10H,3-7H2,1-2H3;9-10H,4-8H2,1-3H3;8-9H,5-7H2,1-4H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;8-9H,4-7H2,1-3H3;2*8-10H,3-7H2,1-2H3;7-9H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6-8H,4-5H2,1-3H3;6-9H,3-5H2,1-2H3
InChIKeyBXZYUIWGTLOQOK-UHFFFAOYSA-N
XLogP25.86
TPSA175.38 Ų
H-Bond Donors10
H-Bond Acceptors27
Rotatable Bonds28
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002621.59
LogP ≤ 525.86
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1027

Analyze N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine with MolForge

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Related Compounds

N-(azepan-4-ylmethyl)-N-methylpropan-2-amine;N-(azepan-4-ylmethyl)propan-2-amine;bis(N-(azetidin-3-ylmethyl)propan-2-amine);N-ethyl-N-propan-2-ylazepan-4-amine;N-ethyl-N-propan-2-ylazetidin-3-amine;N-ethyl-N-propan-2-ylpiperidin-4-amine;N-ethyl-N-propan-2-ylpyrrolidin-3-amine;methane;N-methyl-N-(piperidin-4-ylmethyl)propan-2-amine;N-methyl-N-propan-2-ylazepan-4-amine;N-methyl-N-propan-2-ylazetidin-3-amine;N-methyl-N-propan-2-ylpiperidin-4-amine;N-methyl-N-propan-2-ylpyrrolidin-3-amine;N-(piperidin-4-ylmethyl)propan-2-amine;N-propan-2-ylazepan-4-amine;N-propan-2-ylazetidin-3-amine;N-propan-2-ylpiperidin-4-amine;N-propan-2-ylpyrrolidin-3-amine;bis(N-(pyrrolidin-3-ylmethyl)propan-2-amine)
CID 157642509
CID 159044384
CID 159044384
N-(azepan-4-ylmethyl)-N-methylpropan-2-amine;N-(azepan-4-ylmethyl)propan-2-amine;N-(azetidin-3-ylmethyl)-N-methylpropan-2-amine;N-(azetidin-3-ylmethyl)propan-2-amine;N-ethyl-N-propan-2-ylazepan-4-amine;N-ethyl-N-propan-2-ylazetidin-3-amine;N-ethyl-N-propan-2-ylpiperidin-4-amine;N-ethyl-N-propan-2-ylpyrrolidin-3-amine;N-methyl-N-(piperidin-4-ylmethyl)propan-2-amine;N-methyl-N-propan-2-ylazepan-4-amine;N-methyl-N-propan-2-ylazetidin-3-amine;N-methyl-N-propan-2-ylpiperidin-4-amine;N-methyl-N-propan-2-ylpyrrolidin-3-amine;N-methyl-N-(pyrrolidin-3-ylmethyl)propan-2-amine;molecular hydrogen;N-(piperidin-4-ylmethyl)propan-2-amine;N-propan-2-ylazepan-4-amine;N-propan-2-ylazetidin-3-amine;N-propan-2-ylpiperidin-4-amine;N-propan-2-ylpyrrolidin-3-amine;N-(pyrrolidin-3-ylmethyl)propan-2-amine
CID 159663200
5-tert-butyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;1-(1-tert-butylazetidin-3-yl)pyrrolidine;8-tert-butyl-2,8-diazaspiro[4.5]decane;1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-4-(1-methylpyrrolidin-1-ium-1-yl)piperidine;1-tert-butyl-4-piperidin-1-ylpiperidine;3-tert-butyl-8-pyrrolidin-1-yl-3-azabicyclo[3.2.1]octane;1-tert-butyl-4-pyrrolidin-1-ylazepane;7-(2,2-dimethylpropyl)-2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 159859018
CID 160216333
CID 160216333
1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole;1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;azetidine;2-tert-butyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-tert-butyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;1-tert-butylazetidine;1-tert-butylpyrrolidine;N,N-di(ethyl)-2-methylpropan-2-amine;pentakis(2,2-dimethylpropane);ethane;N-ethylethanamine;N-ethyl-2-methyl-N-propylpropan-2-amine;N-ethylpropan-1-amine;2-methylpropane;pyrrolidine;tetrakis(yttrium)
CID 161014473
CID 161579368
CID 161579368
N-(azepan-4-ylmethyl)-N-methylpropan-2-amine;N-(azepan-4-ylmethyl)propan-2-amine;N-(azetidin-3-ylmethyl)-N-methylpropan-2-amine;N-(azetidin-3-ylmethyl)propan-2-amine;N-ethyl-N-propan-2-ylazepan-4-amine;N-ethyl-N-propan-2-ylazetidin-3-amine;N-ethyl-N-propan-2-ylpiperidin-4-amine;N-ethyl-N-propan-2-ylpyrrolidin-3-amine;N-methyl-N-(piperidin-4-ylmethyl)propan-2-amine;N-methyl-N-propan-2-ylazepan-4-amine;N-methyl-N-propan-2-ylazetidin-3-amine;N-methyl-N-propan-2-ylpiperidin-4-amine;N-methyl-N-propan-2-ylpyrrolidin-3-amine;N-methyl-N-(pyrrolidin-3-ylmethyl)propan-2-amine;N-(piperidin-4-ylmethyl)propan-2-amine;N-propan-2-ylazepan-4-amine;N-propan-2-ylazetidin-3-amine;N-propan-2-ylpiperidin-4-amine;N-propan-2-ylpyrrolidin-3-amine;N-(pyrrolidin-3-ylmethyl)propan-2-amine
CID 162105992
CID 163450133
CID 163450133
CID 163559915
CID 163559915
CID 164068603
CID 164068603
6-tert-butyl-1,2,3,5,7,7a-hexahydroimidazo[1,5-c]imidazole;6-tert-butyl-2,3,5,7,8,8a-hexahydro-1H-imidazo[1,5-c]pyrimidine;6-tert-butyl-1,2,3,5,6,7,8,8a-octahydroimidazo[1,5-a]pyridine;2,6-ditert-butyl-1,3,5,7,8,8a-hexahydroimidazo[1,5-c]pyrimidine;2,7-ditert-butyl-3,4,4a,5,6,8-hexahydro-1H-pyrimido[1,6-c]pyrimidine;bis(2,8-ditert-butyl-1,3,4,4a,5,6,7,9-octahydropyrimido[1,6-c][1,3]diazepine);3,6-ditert-butyl-1,3,6-triazabicyclo[3.2.0]heptane;3,7-ditert-butyl-1,3,7-triazabicyclo[4.2.0]octane;tris(2-methylpropane)
CID 164948417

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine?
The IUPAC name of N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine (CID 157497547) is N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine.
What is the SMILES notation for N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine?
The canonical SMILES for N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine is CC(C)CC1CCCNC1.CC(C)CC1CCN(C)CC1.CC(C)N1CC2(CCCCN2)C1.CC(C)N1CC2CCCC21.CC(C)N1CC2CCN(C)C2C1.CC(C)N1CCC(N(C)C)C1.CC(C)N1CCC(N2CCCCC2)C1.CC(C)N1CCC2(CCCCN2)CC1.CC(C)N1CCC2(CCNC2)CC1.CC(C)N1CCC2CCCC21.CC(C)N1CCCCC1.CC(C)NCC1CCN1.CC(C)NCCC1CCC1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CCN1.CNC1CCN(C(C)C)C1.CNC1CN(C(C)C)C1.
What is the InChIKey of N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine?
The InChIKey is BXZYUIWGTLOQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H24N2.C11H22N2.2C10H20N2.C10H19N.C10H21N.2C9H20N2.C9H17N.3C9H19N.C8H18N2.C8H17N.2C7H16N2/c1-11(2)14-9-6-12(7-10-14)5-3-4-8-13-12;1-11(2)14-9-6-12(10-14)13-7-4-3-5-8-13;1-10(2)13-7-4-11(5-8-13)3-6-12-9-11;1-8(2)12-6-9-4-5-11(3)10(9)7-12;1-9(2)12-7-10(8-12)5-3-4-6-11-10;1-8(2)11-7-6-9-4-3-5-10(9)11;1-9(2)8-10-4-6-11(3)7-5-10;1-8(2)11-6-5-9(7-11)10(3)4;1-8(2)11-6-4-9(3)10-5-7-11;1-7(2)10-6-8-4-3-5-9(8)10;1-8(2)10-6-4-9(3)5-7-10;1-8(2)6-9-4-3-5-10-7-9;1-8(2)10-7-6-9-4-3-5-9;1-7(2)10-5-4-8(6-10)9-3;1-8(2)9-6-4-3-5-7-9;1-6(2)9-4-7(5-9)8-3;1-6(2)9-5-7-3-4-8-7/h11,13H,3-10H2,1-2H3;11-12H,3-10H2,1-2H3;10,12H,3-9H2,1-2H3;8-10H,4-7H2,1-3H3;9,11H,3-8H2,1-2H3;8-10H,3-7H2,1-2H3;9-10H,4-8H2,1-3H3;8-9H,5-7H2,1-4H3;8-10H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;8-9H,4-7H2,1-3H3;2*8-10H,3-7H2,1-2H3;7-9H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6-8H,4-5H2,1-3H3;6-9H,3-5H2,1-2H3.
What are the key properties of N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine?
N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine has a molecular weight of 2621.59 g/mol, XLogP of 25.86, 28 rotatable bonds, 10 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-2-ylmethyl)propan-2-amine;N-(2-cyclobutylethyl)propan-2-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1-methyl-4-(2-methylpropyl)piperidine;1-methyl-5-propan-2-yl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole;N-methyl-1-propan-2-ylazetidin-3-amine;5-methyl-1-propan-2-yl-1,4-diazepane;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpyrrolidin-3-amine;3-(2-methylpropyl)piperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;6-propan-2-yl-6-azabicyclo[3.2.0]heptane;8-propan-2-yl-2,8-diazaspiro[4.5]decane;2-propan-2-yl-2,5-diazaspiro[3.5]nonane;9-propan-2-yl-1,9-diazaspiro[5.5]undecane;1-propan-2-ylpiperidine;1-(1-propan-2-ylpyrrolidin-3-yl)piperidine is sourced from PubChem (CID 157497547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).