N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide

C16H28N2O2 — CID 131926304

IUPACN-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide
SMILESCC1(CNC(=O)CCCN2CCCCC2=O)CCCC1
InChIInChI=1S/C16H28N2O2/c1-16(9-3-4-10-16)13-17-14(19)7-6-12-18-11-5-2-8-15(18)20/h2-13H2,1H3,(H,17,19)
InChIKeyODSASQIXKWNCEP-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.48
Rot. Bonds6

About N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide

N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide (PubChem CID 131926304) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide.

Molecular Properties

Compound NameN-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide
PubChem CID131926304
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide
SMILESCC1(CNC(=O)CCCN2CCCCC2=O)CCCC1
InChIInChI=1S/C16H28N2O2/c1-16(9-3-4-10-16)13-17-14(19)7-6-12-18-11-5-2-8-15(18)20/h2-13H2,1H3,(H,17,19)
InChIKeyODSASQIXKWNCEP-UHFFFAOYSA-N
XLogP2.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-[(3,5-dimethylpyrazol-1-yl)methyl]cyclopropyl]methyl]-4-(2-oxopiperidin-1-yl)butanamide
CID 131897807
4-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-[2-(2-oxoazepan-1-yl)ethyl]butanamide
CID 55688364
4-(2-oxopiperidin-1-yl)butanoic acid
CID 12842029
N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-(2-oxopiperidin-1-yl)butanamide
CID 131908174
N-[2-[methyl(methylsulfonyl)amino]ethyl]-4-(2-oxopiperidin-1-yl)butanamide
CID 131910183
4-(2-oxoazepan-1-yl)butanamide
CID 90945049
5-[(1-methylcyclopentyl)methylamino]-5-oxopentanoic acid
CID 63822209
N-[2-(2-oxopiperidin-1-yl)ethyl]propanamide
CID 110722707
N-[3-(2-oxopyrrolidin-1-yl)propyl]butanamide
CID 123515256
1-amino-N-[3-(2-oxoazepan-1-yl)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119270408
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanoic acid
CID 139516844
4-[3-(2-oxopiperidin-1-yl)propanoylamino]butanamide
CID 139517074

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide?
The IUPAC name of N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide (CID 131926304) is N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide.
What is the SMILES notation for N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide?
The canonical SMILES for N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide is CC1(CNC(=O)CCCN2CCCCC2=O)CCCC1.
What is the InChIKey of N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide?
The InChIKey is ODSASQIXKWNCEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-16(9-3-4-10-16)13-17-14(19)7-6-12-18-11-5-2-8-15(18)20/h2-13H2,1H3,(H,17,19).
What are the key properties of N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide?
N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide has a molecular weight of 280.41 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclopentyl)methyl]-4-(2-oxopiperidin-1-yl)butanamide is sourced from PubChem (CID 131926304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).