N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

C16H31N3 — CID 83108296

IUPACN-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCC1(N(C)C)CCCC1)C2
InChIInChI=1S/C16H31N3/c1-18(2)16(8-4-5-9-16)12-17-13-10-14-6-7-15(11-13)19(14)3/h13-15,17H,4-12H2,1-3H3
InChIKeyXYIKHFPAYUBVIS-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.08
Rot. Bonds4

About N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 83108296) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID83108296
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC NameN-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NCC1(N(C)C)CCCC1)C2
InChIInChI=1S/C16H31N3/c1-18(2)16(8-4-5-9-16)12-17-13-10-14-6-7-15(11-13)19(14)3/h13-15,17H,4-12H2,1-3H3
InChIKeyXYIKHFPAYUBVIS-UHFFFAOYSA-N
XLogP2.08
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(dimethylamino)cyclopentyl]methyl]-1,2-dimethylpiperidin-4-amine
CID 81302342
N-[[1-(dimethylamino)cyclopentyl]methyl]pyrrolidin-3-amine
CID 83107682
8-[[1-(dimethylamino)cyclopentyl]methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 83114315
N,N-dimethyl-1-[[(3-phenylcyclobutyl)amino]methyl]cyclopentan-1-amine
CID 83116777
N-[[1-(dimethylamino)cyclopentyl]methyl]oxepan-4-amine
CID 83116241
N-[[1-(dimethylamino)cyclohexyl]methyl]-1-prop-2-ynylpiperidin-4-amine
CID 43766456
N-[[1-(dimethylamino)cyclohexyl]methyl]-1-ethylazepan-4-amine
CID 65072853
N-[[1-(dimethylamino)cyclobutyl]methyl]-1-propan-2-ylazepan-4-amine
CID 105414514
3-methyl-1-[[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]methyl]cyclohexan-1-ol
CID 65116922
N-[[1-(dimethylamino)cyclohexyl]methyl]-1-ethylpiperidin-3-amine
CID 50984370
N-[[1-(dimethylamino)cyclohexyl]methyl]oxepan-4-amine
CID 65076450
N-[[1-(dimethylamino)cyclopentyl]methyl]-1,9-dioxaspiro[5.5]undecan-4-amine
CID 83112995

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (CID 83108296) is N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is CN1C2CCC1CC(NCC1(N(C)C)CCCC1)C2.
What is the InChIKey of N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is XYIKHFPAYUBVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-18(2)16(8-4-5-9-16)12-17-13-10-14-6-7-15(11-13)19(14)3/h13-15,17H,4-12H2,1-3H3.
What are the key properties of N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 265.44 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclopentyl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 83108296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).