1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide

C17H22N2O2 — CID 119137406

IUPAC1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CC/C=C/c2ccccc2)CC1
InChIInChI=1S/C17H22N2O2/c18-17(21)15-10-12-19(13-11-15)16(20)9-5-4-8-14-6-2-1-3-7-14/h1-4,6-8,15H,5,9-13H2,(H2,18,21)/b8-4+
InChIKeyONEGCUVSQGCMKO-XBXARRHUSA-N
MW286.38 g/mol
LogP2.20
Rot. Bonds5

About 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide

1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide (PubChem CID 119137406) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide
PubChem CID119137406
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CC/C=C/c2ccccc2)CC1
InChIInChI=1S/C17H22N2O2/c18-17(21)15-10-12-19(13-11-15)16(20)9-5-4-8-14-6-2-1-3-7-14/h1-4,6-8,15H,5,9-13H2,(H2,18,21)/b8-4+
InChIKeyONEGCUVSQGCMKO-XBXARRHUSA-N
XLogP2.20
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-phenylprop-2-enoyl)piperidine-4-carboxamide
CID 846355
4-(4-carbamoylpiperidin-1-yl)-4-oxobutanoic acid
CID 2826389
1-[2-(benzenesulfonyl)acetyl]piperidine-4-carboxamide
CID 17312294
(E)-5-phenylpent-4-enoic acid
CID 5370650
1-[4-(N-methylsulfonylanilino)butanoyl]piperidine-4-carboxamide
CID 6500036
[2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] 2-phenoxyacetate
CID 7980424
1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide
CID 17408046
1-(3-phenylpropanoyl)piperidine-4-carboxylate
CID 6930824
1-[1-(3-phenylpropanoyl)azetidin-3-yl]piperidine-4-carboxamide
CID 121153798
1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide
CID 110696934
1-(5-hydroxypentanoyl)piperidine-4-carboxamide
CID 79199439
[2-(4-carbamoylpiperidin-1-yl)-2-oxoethyl] (E)-3-(2-chlorophenyl)prop-2-enoate
CID 8022379

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide?
The IUPAC name of 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide (CID 119137406) is 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)CC/C=C/c2ccccc2)CC1.
What is the InChIKey of 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide?
The InChIKey is ONEGCUVSQGCMKO-XBXARRHUSA-N. The full InChI is InChI=1S/C17H22N2O2/c18-17(21)15-10-12-19(13-11-15)16(20)9-5-4-8-14-6-2-1-3-7-14/h1-4,6-8,15H,5,9-13H2,(H2,18,21)/b8-4+.
What are the key properties of 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide?
1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide has a molecular weight of 286.38 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-5-phenylpent-4-enoyl]piperidine-4-carboxamide is sourced from PubChem (CID 119137406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).