N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide

C23H26N2O3 — CID 33215029

IUPACN-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide
SMILESCC(=O)c1ccc(NC(=O)CCN2CCC(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C23H26N2O3/c1-17(26)18-7-9-21(10-8-18)24-22(27)13-16-25-14-11-20(12-15-25)23(28)19-5-3-2-4-6-19/h2-10,20H,11-16H2,1H3,(H,24,27)
InChIKeyABYJIJPGRRJYFH-UHFFFAOYSA-N
MW378.47 g/mol
LogP3.81
Rot. Bonds7

About N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide

N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide (PubChem CID 33215029) has the molecular formula C23H26N2O3 and a molecular weight of 378.47 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide
PubChem CID33215029
Molecular FormulaC23H26N2O3
Molecular Weight378.47 g/mol
Exact Mass378.19
IUPAC NameN-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide
SMILESCC(=O)c1ccc(NC(=O)CCN2CCC(C(=O)c3ccccc3)CC2)cc1
InChIInChI=1S/C23H26N2O3/c1-17(26)18-7-9-21(10-8-18)24-22(27)13-16-25-14-11-20(12-15-25)23(28)19-5-3-2-4-6-19/h2-10,20H,11-16H2,1H3,(H,24,27)
InChIKeyABYJIJPGRRJYFH-UHFFFAOYSA-N
XLogP3.81
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-benzoylpiperidin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 33215032
N-(4-acetylphenyl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 155569851
N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
CID 31932540
3-(4-benzoylpiperidin-1-yl)-N-(3-chlorophenyl)propanamide
CID 33215010
1-[3-(4-acetylanilino)-3-oxopropyl]-N-methyl-N-propan-2-ylpiperidine-4-carboxamide
CID 37461440
3-(4-benzoylpiperidin-1-yl)-N-naphthalen-1-ylpropanamide
CID 33215004
N-(3-fluorophenyl)-3-[4-(4-methylbenzoyl)piperidin-1-yl]propanamide
CID 55864910
N-(4-acetamidophenyl)-3-(4-benzylpiperidin-1-yl)propanamide
CID 109032583
N-(3-acetylphenyl)-2-[4-(4-methylbenzoyl)piperidin-1-yl]acetamide
CID 52689774
propan-2-yl 3-(4-benzoylpiperidin-1-yl)propanoate
CID 56807214
N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 119919130
N-[4-(cyclopropanecarbonyl)phenyl]-5-oxo-5-phenylpentanamide
CID 110425861

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide (CID 33215029) is N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide is CC(=O)c1ccc(NC(=O)CCN2CCC(C(=O)c3ccccc3)CC2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide?
The InChIKey is ABYJIJPGRRJYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O3/c1-17(26)18-7-9-21(10-8-18)24-22(27)13-16-25-14-11-20(12-15-25)23(28)19-5-3-2-4-6-19/h2-10,20H,11-16H2,1H3,(H,24,27).
What are the key properties of N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide?
N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide has a molecular weight of 378.47 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide is sourced from PubChem (CID 33215029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).