N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide

C23H22N2O3 — CID 60571640

IUPACN-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide
SMILESCC(NC(=O)c1ccccc1Oc1ccccc1)C(=O)NCc1ccccc1
InChIInChI=1S/C23H22N2O3/c1-17(22(26)24-16-18-10-4-2-5-11-18)25-23(27)20-14-8-9-15-21(20)28-19-12-6-3-7-13-19/h2-15,17H,16H2,1H3,(H,24,26)(H,25,27)
InChIKeyMQLAJVBKPVWRBC-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.91
Rot. Bonds7

About N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide

N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide (PubChem CID 60571640) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide.

Molecular Properties

Compound NameN-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide
PubChem CID60571640
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC NameN-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide
SMILESCC(NC(=O)c1ccccc1Oc1ccccc1)C(=O)NCc1ccccc1
InChIInChI=1S/C23H22N2O3/c1-17(22(26)24-16-18-10-4-2-5-11-18)25-23(27)20-14-8-9-15-21(20)28-19-12-6-3-7-13-19/h2-15,17H,16H2,1H3,(H,24,26)(H,25,27)
InChIKeyMQLAJVBKPVWRBC-UHFFFAOYSA-N
XLogP3.91
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(benzylamino)-1-oxopropan-2-yl]-4-phenoxybenzamide
CID 60571476
N-pentan-3-yl-2-phenoxybenzamide
CID 884731
N-[1-(benzylamino)-1-oxopropan-2-yl]-2-(4-methylbenzoyl)benzamide
CID 60571715
N-[(2S)-1-oxo-1-(2-phenoxyanilino)propan-2-yl]naphthalene-1-carboxamide
CID 169183052
N-[(2R)-1-methoxypropan-2-yl]-2-phenoxybenzamide
CID 884755
2-chloro-N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 2712751
N-benzyl-2-(methylcarbamoylamino)propanamide
CID 47377374
N-octan-2-yl-2-phenoxybenzamide
CID 4673195
N-[1-(benzylamino)-1-oxopropan-2-yl]-5-bromo-2-hydroxybenzamide
CID 60571641
2-[(2-phenoxybenzoyl)amino]-N-propan-2-ylbenzamide
CID 1251991
(2S)-2-acetamido-N-[(2S)-1-(benzylamino)-1-oxopropan-2-yl]propanamide
CID 167024593
N-benzhydryl-2-phenoxybenzamide
CID 3401619

Frequently Asked Questions

What is the IUPAC name of N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide?
The IUPAC name of N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide (CID 60571640) is N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide.
What is the SMILES notation for N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide?
The canonical SMILES for N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide is CC(NC(=O)c1ccccc1Oc1ccccc1)C(=O)NCc1ccccc1.
What is the InChIKey of N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide?
The InChIKey is MQLAJVBKPVWRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-17(22(26)24-16-18-10-4-2-5-11-18)25-23(27)20-14-8-9-15-21(20)28-19-12-6-3-7-13-19/h2-15,17H,16H2,1H3,(H,24,26)(H,25,27).
What are the key properties of N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide?
N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide has a molecular weight of 374.44 g/mol, XLogP of 3.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(benzylamino)-1-oxopropan-2-yl]-2-phenoxybenzamide is sourced from PubChem (CID 60571640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).