N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide

C18H26N2O — CID 119275845

IUPACN-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)C1CCNCC1
InChIInChI=1S/C18H26N2O/c21-17(15-8-12-19-13-9-15)20-14-18(10-4-5-11-18)16-6-2-1-3-7-16/h1-3,6-7,15,19H,4-5,8-14H2,(H,20,21)
InChIKeyAOORAYCKBKXTGX-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.61
Rot. Bonds4

About N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide

N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide (PubChem CID 119275845) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
PubChem CID119275845
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)C1CCNCC1
InChIInChI=1S/C18H26N2O/c21-17(15-8-12-19-13-9-15)20-14-18(10-4-5-11-18)16-6-2-1-3-7-16/h1-3,6-7,15,19H,4-5,8-14H2,(H,20,21)
InChIKeyAOORAYCKBKXTGX-UHFFFAOYSA-N
XLogP2.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-phenylcyclobutyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119699128
N-[(1-phenylcyclopentyl)methyl]cyclohexanecarboxamide
CID 18128273
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide
CID 119310492
N-[(1-phenylcyclohexyl)methyl]oxane-4-carboxamide
CID 51078296
N-[(1-phenylcyclopentyl)methyl]pyrrolidine-2-carboxamide
CID 110481276
N-[[1-(4-chlorophenyl)cyclopentyl]methyl]pyrrolidine-3-carboxamide
CID 119749968
3-amino-N-[(1-phenylcyclopentyl)methyl]cyclopentane-1-carboxamide
CID 119698154
(3S)-N-[(1-phenylcyclopentyl)methyl]oxolane-3-carboxamide
CID 95272452
N-[2-[[N'-methyl-N-[(1-phenylcyclopentyl)methyl]carbamimidoyl]amino]ethyl]cyclopropanecarboxamide
CID 111852426
(1S,3R,4R)-3-amino-4-hydroxy-N-[(1-phenylcyclohexyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 155940030
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-3-carboxamide
CID 119293577
(2S,4S)-2-methyl-N-[(4-phenyloxan-4-yl)methyl]piperidine-4-carboxamide
CID 120623333

Frequently Asked Questions

What is the IUPAC name of N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide (CID 119275845) is N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide is O=C(NCC1(c2ccccc2)CCCC1)C1CCNCC1.
What is the InChIKey of N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide?
The InChIKey is AOORAYCKBKXTGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c21-17(15-8-12-19-13-9-15)20-14-18(10-4-5-11-18)16-6-2-1-3-7-16/h1-3,6-7,15,19H,4-5,8-14H2,(H,20,21).
What are the key properties of N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide?
N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 119275845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).