N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine

C18H28N2 — CID 83997890

IUPACN-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine
SMILESCC1CC(NCC2CCCC2)CN(c2ccccc2)C1
InChIInChI=1S/C18H28N2/c1-15-11-17(19-12-16-7-5-6-8-16)14-20(13-15)18-9-3-2-4-10-18/h2-4,9-10,15-17,19H,5-8,11-14H2,1H3
InChIKeyQMCVZTODKYKGGL-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.68
Rot. Bonds4

About N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine

N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine (PubChem CID 83997890) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine
PubChem CID83997890
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine
SMILESCC1CC(NCC2CCCC2)CN(c2ccccc2)C1
InChIInChI=1S/C18H28N2/c1-15-11-17(19-12-16-7-5-6-8-16)14-20(13-15)18-9-3-2-4-10-18/h2-4,9-10,15-17,19H,5-8,11-14H2,1H3
InChIKeyQMCVZTODKYKGGL-UHFFFAOYSA-N
XLogP3.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclobutylmethyl)-5-methyl-1-(4-methylphenyl)piperidin-3-amine
CID 83997250
N-(cyclopentylmethyl)-1-(3-fluorophenyl)-5-methylpiperidin-3-amine
CID 83997928
N-(cyclohexylmethyl)-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83998607
N-(cyclopropylmethyl)-1-(3-methoxyphenyl)-5-methylpiperidin-3-amine
CID 83996532
N-(cyclobutylmethyl)-1-(3,4-difluorophenyl)-5-methylpiperidin-3-amine
CID 83997239
N-(cyclohexylmethyl)-1-phenylpiperidin-3-amine
CID 83998581
1-benzyl-N-(cyclobutylmethyl)-5-methylpiperidin-3-amine
CID 83997025
N-(cyclobutylmethyl)-1-(2,3-difluorophenyl)-5-methylpiperidin-3-amine
CID 83997260
N-(cyclopentylmethyl)-5-ethyl-1-(3-fluorophenyl)piperidin-3-amine
CID 83997929
N-(cyclohexylmethyl)-5-ethyl-1-(3-fluorophenyl)piperidin-3-amine
CID 83998621
ethyl N-(5-methyl-1-phenylpiperidin-3-yl)carbamate
CID 112543896
N-(cyclopentylmethyl)-5-methyl-1-(2-methylpropyl)piperidin-3-amine
CID 83997686

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine?
The IUPAC name of N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine (CID 83997890) is N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine?
The canonical SMILES for N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine is CC1CC(NCC2CCCC2)CN(c2ccccc2)C1.
What is the InChIKey of N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine?
The InChIKey is QMCVZTODKYKGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-15-11-17(19-12-16-7-5-6-8-16)14-20(13-15)18-9-3-2-4-10-18/h2-4,9-10,15-17,19H,5-8,11-14H2,1H3.
What are the key properties of N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine?
N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine has a molecular weight of 272.44 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-5-methyl-1-phenylpiperidin-3-amine is sourced from PubChem (CID 83997890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).