1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide

C24H30N2O2 — CID 86849831

IUPAC1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide
SMILESCCCC(=O)N1CCC(C(=O)N(CCc2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C24H30N2O2/c1-2-9-23(27)25-17-15-21(16-18-25)24(28)26(22-12-7-4-8-13-22)19-14-20-10-5-3-6-11-20/h3-8,10-13,21H,2,9,14-19H2,1H3
InChIKeyUOWJWCCNICDHDM-UHFFFAOYSA-N
MW378.52 g/mol
LogP4.30
Rot. Bonds7

About 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide

1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide (PubChem CID 86849831) has the molecular formula C24H30N2O2 and a molecular weight of 378.52 g/mol. Its IUPAC name is 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide
PubChem CID86849831
Molecular FormulaC24H30N2O2
Molecular Weight378.52 g/mol
Exact Mass378.23
IUPAC Name1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide
SMILESCCCC(=O)N1CCC(C(=O)N(CCc2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C24H30N2O2/c1-2-9-23(27)25-17-15-21(16-18-25)24(28)26(22-12-7-4-8-13-22)19-14-20-10-5-3-6-11-20/h3-8,10-13,21H,2,9,14-19H2,1H3
InChIKeyUOWJWCCNICDHDM-UHFFFAOYSA-N
XLogP4.30
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.52
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 1-[3-[butanoyl(2-phenylethyl)amino]propanoyl]piperidine-4-carboxylate
CID 42699660
1-[2-(4-chlorophenyl)acetyl]-N-ethyl-N-phenylpiperidine-4-carboxamide
CID 113006703
1-acetyl-N-(3-chloropropyl)-N-phenylpiperidine-4-carboxamide
CID 141232304
1-[4-[(N-methylanilino)methyl]piperidin-1-yl]butan-1-one
CID 141371316
ethyl 1-(3-phenylpropanoyl)piperidine-4-carboxylate
CID 669998
N-ethyl-1-(2-methylpropanoyl)-N-phenylpiperidine-4-carboxamide
CID 113006682
2-[(1-acetylpiperidine-4-carbonyl)-(2-phenylethyl)amino]acetic acid
CID 119347235
1-(3-phenylpropanoyl)piperidine-4-carboxylate
CID 6930824
1-(4-benzylpiperazin-1-yl)butan-1-one
CID 874457
4-[3-[4-[butyl(methyl)carbamoyl]piperidin-1-yl]-3-oxopropyl]benzoic acid
CID 119181832
1-[3-(4-ethylphenyl)propanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 84514231
ethyl 4-methyl-2-[pentyl-[1-(3-phenylpropanoyl)piperidine-4-carbonyl]amino]-1,3-thiazole-5-carboxylate
CID 55632993

Frequently Asked Questions

What is the IUPAC name of 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide (CID 86849831) is 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide is CCCC(=O)N1CCC(C(=O)N(CCc2ccccc2)c2ccccc2)CC1.
What is the InChIKey of 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide?
The InChIKey is UOWJWCCNICDHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O2/c1-2-9-23(27)25-17-15-21(16-18-25)24(28)26(22-12-7-4-8-13-22)19-14-20-10-5-3-6-11-20/h3-8,10-13,21H,2,9,14-19H2,1H3.
What are the key properties of 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide?
1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide has a molecular weight of 378.52 g/mol, XLogP of 4.30, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butanoyl-N-phenyl-N-(2-phenylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 86849831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).