1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide

C22H26N2O3 — CID 110298361

IUPAC1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-16(2)27-20-10-8-19(9-11-20)23-21(25)17-12-14-24(15-13-17)22(26)18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,23,25)
InChIKeyYJEJLDCWHBZXNL-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.96
Rot. Bonds5

About 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide

1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide (PubChem CID 110298361) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide
PubChem CID110298361
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC Name1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide
SMILESCC(C)Oc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C22H26N2O3/c1-16(2)27-20-10-8-19(9-11-20)23-21(25)17-12-14-24(15-13-17)22(26)18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,23,25)
InChIKeyYJEJLDCWHBZXNL-UHFFFAOYSA-N
XLogP3.96
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropanecarbonyl)-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide
CID 47044071
4-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119177742
1-(4-propan-2-yloxybenzoyl)piperidine-4-carboxylic acid
CID 17200636
1-(4-benzamidobenzoyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 46384509
1-benzoyl-N-(4-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 110298371
1-[4-(4-carbamoylphenoxy)benzoyl]-N-phenylpiperidine-4-carboxamide
CID 56545504
3-(4-methylpiperidine-1-carbonyl)-N-(4-propan-2-yloxyphenyl)benzamide
CID 109052369
1-(4-benzamidobenzoyl)-N-(2-methylpropyl)piperidine-4-carboxamide
CID 46384551
4-(4-methylpiperazine-1-carbonyl)-N-(4-propan-2-yloxyphenyl)cyclohexane-1-carboxamide
CID 109147452
1-benzoyl-N-[4-(diethoxyphosphorylmethyl)phenyl]piperidine-4-carboxamide
CID 3520152
1-benzoyl-N-[2,6-di(propan-2-yl)phenyl]piperidine-4-carboxamide
CID 113008347
1-(4-tert-butylbenzoyl)-N-phenylpiperidine-4-carboxamide
CID 113006047

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide (CID 110298361) is 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide is CC(C)Oc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1.
What is the InChIKey of 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide?
The InChIKey is YJEJLDCWHBZXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-16(2)27-20-10-8-19(9-11-20)23-21(25)17-12-14-24(15-13-17)22(26)18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H,23,25).
What are the key properties of 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide?
1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide has a molecular weight of 366.46 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-(4-propan-2-yloxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 110298361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).