1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide

C24H40N2O2 — CID 143593847

IUPAC1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide
SMILESC=CC(NC(=O)C1CCN(C(=O)CC2CCCCC2)CC1)C1CCC(CC)C1
InChIInChI=1S/C24H40N2O2/c1-3-18-10-11-21(16-18)22(4-2)25-24(28)20-12-14-26(15-13-20)23(27)17-19-8-6-5-7-9-19/h4,18-22H,2-3,5-17H2,1H3,(H,25,28)
InChIKeyVNOMPDAMDZZOJL-UHFFFAOYSA-N
MW388.60 g/mol
LogP4.69
Rot. Bonds7

About 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide

1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide (PubChem CID 143593847) has the molecular formula C24H40N2O2 and a molecular weight of 388.60 g/mol. Its IUPAC name is 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide
PubChem CID143593847
Molecular FormulaC24H40N2O2
Molecular Weight388.60 g/mol
Exact Mass388.31
IUPAC Name1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide
SMILESC=CC(NC(=O)C1CCN(C(=O)CC2CCCCC2)CC1)C1CCC(CC)C1
InChIInChI=1S/C24H40N2O2/c1-3-18-10-11-21(16-18)22(4-2)25-24(28)20-12-14-26(15-13-20)23(27)17-19-8-6-5-7-9-19/h4,18-22H,2-3,5-17H2,1H3,(H,25,28)
InChIKeyVNOMPDAMDZZOJL-UHFFFAOYSA-N
XLogP4.69
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.60
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-[(3S)-1-cyclopentyl-2-oxohex-5-en-3-yl]-4-(4,4-difluoropiperidin-1-yl)-2-methylbutanamide
CID 168386500
N-butan-2-yl-2-methyl-1-pent-4-enoyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-4-carboxamide
CID 72135395
4-[2-[1-(1-methylpiperidin-4-yl)ethenylamino]propyl]-N-propan-2-ylcyclohexane-1-carboxamide
CID 139475314
3-[cyclopentyl(methyl)amino]-N-[(4,6-dimethyl-2-oxopiperidin-3-yl)methyl]-2-ethenylcyclohexane-1-carboxamide
CID 140641697
(2S)-2-but-3-enyl-3-(cyclopentylmethyl)-N'-propan-2-ylbutanediamide
CID 163702477
3-ethenyl-5-methyl-2-(2-methylpropanoyl)-N-(2-piperidin-1-ylethyl)cyclopentane-1-carboxamide
CID 167106126
3-ethenyl-5-methyl-2-(2-methylpropanoyl)-N-(2-piperazin-1-ylethyl)cyclopentane-1-carboxamide
CID 167106270
6-methyl-N-(1-prop-2-enylpiperidin-4-yl)hexadecanamide
CID 174637997
6-methyl-N-(1-prop-2-enylpiperidin-4-yl)tetradecanamide
CID 174650133
1-[4-(4-butylpiperidine-1-carbonyl)cyclohexyl]ethanone;2-methyl-N-prop-2-enylpentan-1-amine
CID 176683996
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-2-cyclopent-2-en-1-ylacetamide
CID 46454583
(1R*,2S*)-N-allyl-N'-[2-(1-propylpiperidin-4-yl)ethyl]cyclohexane-1,2-dicarboxamide
CID 50956960

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide?
The IUPAC name of 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide (CID 143593847) is 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide is C=CC(NC(=O)C1CCN(C(=O)CC2CCCCC2)CC1)C1CCC(CC)C1.
What is the InChIKey of 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide?
The InChIKey is VNOMPDAMDZZOJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H40N2O2/c1-3-18-10-11-21(16-18)22(4-2)25-24(28)20-12-14-26(15-13-20)23(27)17-19-8-6-5-7-9-19/h4,18-22H,2-3,5-17H2,1H3,(H,25,28).
What are the key properties of 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide?
1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide has a molecular weight of 388.60 g/mol, XLogP of 4.69, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylacetyl)-N-[1-(3-ethylcyclopentyl)prop-2-enyl]piperidine-4-carboxamide is sourced from PubChem (CID 143593847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).