1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide

C13H20N2O2 — CID 167647096

IUPAC1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide
SMILESC=C1CCC(NC(=O)C2(C)CCCC2)C(=O)N1
InChIInChI=1S/C13H20N2O2/c1-9-5-6-10(11(16)14-9)15-12(17)13(2)7-3-4-8-13/h10H,1,3-8H2,2H3,(H,14,16)(H,15,17)
InChIKeyVPBITONUSPLOBA-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.48
Rot. Bonds2

About 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide

1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide (PubChem CID 167647096) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide
PubChem CID167647096
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide
SMILESC=C1CCC(NC(=O)C2(C)CCCC2)C(=O)N1
InChIInChI=1S/C13H20N2O2/c1-9-5-6-10(11(16)14-9)15-12(17)13(2)7-3-4-8-13/h10H,1,3-8H2,2H3,(H,14,16)(H,15,17)
InChIKeyVPBITONUSPLOBA-UHFFFAOYSA-N
XLogP1.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,6-Di(butan-2-yl)-5-methylidenepiperazin-2-one
CID 70648150
ethane;N-[(2S)-1-(ethylamino)-4-[(2S)-2-methylpiperidin-1-yl]-1-oxopent-4-en-2-yl]-4,4-dimethylpentanamide;molecular hydrogen
CID 142558098
[(2S)-4-methyl-6-methylidenepiperidin-2-yl]-piperidin-1-ylmethanone
CID 144600111
3-tert-butyl-N-(6-methylidene-2-oxopiperidin-3-yl)bicyclo[1.1.1]pentane-1-carboxamide
CID 157300461
ethane;methanamine;N-(6-methylidene-2-oxopiperidin-3-yl)bicyclo[1.1.1]pentane-1-carboxamide
CID 170748956
N-(cyclohexen-1-yl)-3,3-dimethyl-1-(2-methylpropanoyl)piperidine-2-carboxamide
CID 10662458
(2S)-N-(cyclohexen-1-yl)-3,3-dimethyl-1-(2-methylpropanoyl)piperidine-2-carboxamide
CID 101005622
(2R)-N-(cyclohexen-1-yl)-3,3-dimethyl-1-(2-methylpropanoyl)piperidine-2-carboxamide
CID 101005623
N-but-3-enyl-3,3-dimethylpiperidine-2-carboxamide
CID 105569104
3,3-dimethyl-N-pent-4-en-2-ylpiperidine-2-carboxamide
CID 105569107
N-cyclopent-3-en-1-yl-3,3-dimethylpiperidine-2-carboxamide
CID 105569115
N-but-3-en-2-yl-3,3-dimethylpiperidine-2-carboxamide
CID 105569125

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide (CID 167647096) is 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide is C=C1CCC(NC(=O)C2(C)CCCC2)C(=O)N1.
What is the InChIKey of 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide?
The InChIKey is VPBITONUSPLOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9-5-6-10(11(16)14-9)15-12(17)13(2)7-3-4-8-13/h10H,1,3-8H2,2H3,(H,14,16)(H,15,17).
What are the key properties of 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide?
1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide has a molecular weight of 236.31 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(6-methylidene-2-oxopiperidin-3-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 167647096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).