(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide

C23H28N2O2 — CID 25473012

IUPAC(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide
SMILESCC(C)(C)c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H28N2O2/c1-23(2,3)18-12-14-19(15-13-18)24-21(26)20-11-7-8-16-25(20)22(27)17-9-5-4-6-10-17/h4-6,9-10,12-15,20H,7-8,11,16H2,1-3H3,(H,24,26)/t20-/m1/s1
InChIKeyFKKOUNQEQYUFHZ-HXUWFJFHSA-N
MW364.49 g/mol
LogP4.62
Rot. Bonds3

About (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide

(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide (PubChem CID 25473012) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide
PubChem CID25473012
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC Name(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide
SMILESCC(C)(C)c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1
InChIInChI=1S/C23H28N2O2/c1-23(2,3)18-12-14-19(15-13-18)24-21(26)20-11-7-8-16-25(20)22(27)17-9-5-4-6-10-17/h4-6,9-10,12-15,20H,7-8,11,16H2,1-3H3,(H,24,26)/t20-/m1/s1
InChIKeyFKKOUNQEQYUFHZ-HXUWFJFHSA-N
XLogP4.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzoyl-N-pyridin-4-ylpiperidine-2-carboxamide
CID 56826411
(2S)-1-benzoyl-N-(4-ethylphenyl)pyrrolidine-2-carboxamide
CID 92668243
1-(4-benzamidobenzoyl)piperidine-2-carboxylic acid
CID 119175893
(2S)-1-(4-methylbenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 92668343
1-benzoyl-N-pyridin-4-ylpyrrolidine-2-carboxamide
CID 138995698
benzyl 2-[(4-tert-butylphenyl)carbamoyl]pyrrolidine-1-carboxylate
CID 91182280
1-benzoyl-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]pyrrolidine-2-carboxamide
CID 112845834
(2S)-1-benzoyl-N-(4-ethoxyphenyl)pyrrolidine-2-carboxamide
CID 92668241
1-(benzenesulfonyl)-N-(4-tert-butylphenyl)piperidine-2-carboxamide
CID 2928504
1-benzoyl-N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]pyrrolidine-2-carboxamide
CID 136577370
2-[4-[[1-(furan-2-carbonyl)piperidine-2-carbonyl]amino]phenyl]-2-methylpropanoic acid
CID 119254206
tert-butyl (2R)-2-(phenylcarbamoyl)piperidine-1-carboxylate
CID 52774591

Frequently Asked Questions

What is the IUPAC name of (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide?
The IUPAC name of (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide (CID 25473012) is (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide is CC(C)(C)c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1.
What is the InChIKey of (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide?
The InChIKey is FKKOUNQEQYUFHZ-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H28N2O2/c1-23(2,3)18-12-14-19(15-13-18)24-21(26)20-11-7-8-16-25(20)22(27)17-9-5-4-6-10-17/h4-6,9-10,12-15,20H,7-8,11,16H2,1-3H3,(H,24,26)/t20-/m1/s1.
What are the key properties of (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide?
(2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-benzoyl-N-(4-tert-butylphenyl)piperidine-2-carboxamide is sourced from PubChem (CID 25473012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).