1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide

C24H28N2O2 — CID 142125162

IUPAC1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide
SMILESCc1ccc(C2(C(=O)N3CCCC(C(=O)Nc4ccccc4)C3)CCC2)cc1
InChIInChI=1S/C24H28N2O2/c1-18-10-12-20(13-11-18)24(14-6-15-24)23(28)26-16-5-7-19(17-26)22(27)25-21-8-3-2-4-9-21/h2-4,8-13,19H,5-7,14-17H2,1H3,(H,25,27)
InChIKeyPPLHIXDZQQRYNX-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.29
Rot. Bonds4

About 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide

1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide (PubChem CID 142125162) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide
PubChem CID142125162
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC Name1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide
SMILESCc1ccc(C2(C(=O)N3CCCC(C(=O)Nc4ccccc4)C3)CCC2)cc1
InChIInChI=1S/C24H28N2O2/c1-18-10-12-20(13-11-18)24(14-6-15-24)23(28)26-16-5-7-19(17-26)22(27)25-21-8-3-2-4-9-21/h2-4,8-13,19H,5-7,14-17H2,1H3,(H,25,27)
InChIKeyPPLHIXDZQQRYNX-UHFFFAOYSA-N
XLogP4.29
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-N-(4-methylphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9071786
[1-(4-methylphenyl)cyclobutyl]-piperidin-1-ylmethanone
CID 146883856
(3S)-1-(adamantane-1-carbonyl)-N-phenylpiperidine-3-carboxamide
CID 27745511
(3R)-1-[1-(4-chlorophenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide;N-[[(3S)-1-[[1-(4-chlorophenyl)cyclobutyl]methyl]piperidin-3-yl]methyl]aniline;methylalumane
CID 158360170
N-(4-methylphenyl)-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 42959912
3-N-phenyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 42928143
[1-(1-phenylcyclopropanecarbonyl)piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 71876645
1-(2-methylbenzoyl)-N-phenylpiperidine-3-carboxamide
CID 17395315
N-[4-[1-(azepane-1-carbonyl)cyclobutyl]phenyl]acetamide
CID 53110570
(3S)-1-N,1-N-dimethyl-3-N-(4-methylphenyl)piperidine-1,3-dicarboxamide
CID 94161128
1-[1-(3-methylphenyl)cyclopropanecarbonyl]-N-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 138996832
1-[1-(cyclopropanecarbonyl)piperidine-4-carbonyl]-N-phenylpiperidine-3-carboxamide
CID 46653762

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide?
The IUPAC name of 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide (CID 142125162) is 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide?
The canonical SMILES for 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide is Cc1ccc(C2(C(=O)N3CCCC(C(=O)Nc4ccccc4)C3)CCC2)cc1.
What is the InChIKey of 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide?
The InChIKey is PPLHIXDZQQRYNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-18-10-12-20(13-11-18)24(14-6-15-24)23(28)26-16-5-7-19(17-26)22(27)25-21-8-3-2-4-9-21/h2-4,8-13,19H,5-7,14-17H2,1H3,(H,25,27).
What are the key properties of 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide?
1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide has a molecular weight of 376.50 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methylphenyl)cyclobutanecarbonyl]-N-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 142125162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).