N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide

C18H33N3O — CID 60600680

IUPACN-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NC2CCN(CC3CCCC3)CC2)C1
InChIInChI=1S/C18H33N3O/c1-15-5-4-10-21(13-15)18(22)19-17-8-11-20(12-9-17)14-16-6-2-3-7-16/h15-17H,2-14H2,1H3,(H,19,22)
InChIKeyPCGJNKKCNNUFFX-UHFFFAOYSA-N
MW307.48 g/mol
LogP3.08
Rot. Bonds3

About N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide

N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide (PubChem CID 60600680) has the molecular formula C18H33N3O and a molecular weight of 307.48 g/mol. Its IUPAC name is N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
PubChem CID60600680
Molecular FormulaC18H33N3O
Molecular Weight307.48 g/mol
Exact Mass307.26
IUPAC NameN-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NC2CCN(CC3CCCC3)CC2)C1
InChIInChI=1S/C18H33N3O/c1-15-5-4-10-21(13-15)18(22)19-17-8-11-20(12-9-17)14-16-6-2-3-7-16/h15-17H,2-14H2,1H3,(H,19,22)
InChIKeyPCGJNKKCNNUFFX-UHFFFAOYSA-N
XLogP3.08
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.48
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(cyclohexylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
CID 60601133
(3S)-3-[(4-methylpiperidin-1-yl)methyl]-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide
CID 100671853
N-[1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-(hydroxymethyl)piperidine-1-carboxamide
CID 71867658
N-[1-(cyclopentylmethyl)pyrrolidin-3-yl]-3-hydroxypiperidine-1-carboxamide
CID 111508901
3-methyl-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]piperidine-1-carboxamide
CID 60606505
3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 110894815
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
3-(hydroxymethyl)-N-(1-propylpiperidin-4-yl)piperidine-1-carboxamide
CID 111508115
(3R)-N-cyclooctyl-3-(hydroxymethyl)piperidine-1-carboxamide
CID 95577956
N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide
CID 175621352
N-(3-methoxycyclopentyl)-3-methylpiperidine-1-carboxamide
CID 103082501
2-[3-(methylamino)pyrrolidin-1-yl]-1-(3-methylpiperidin-1-yl)ethanone
CID 115300483

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide (CID 60600680) is N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide is CC1CCCN(C(=O)NC2CCN(CC3CCCC3)CC2)C1.
What is the InChIKey of N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide?
The InChIKey is PCGJNKKCNNUFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3O/c1-15-5-4-10-21(13-15)18(22)19-17-8-11-20(12-9-17)14-16-6-2-3-7-16/h15-17H,2-14H2,1H3,(H,19,22).
What are the key properties of N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide?
N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide has a molecular weight of 307.48 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 60600680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).