N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide

C24H23NO3 — CID 58543320

IUPACN-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide
SMILESO=C(CCC(=O)NCc1ccccc1)Cc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C24H23NO3/c26-21(14-15-24(27)25-18-19-8-3-1-4-9-19)16-20-10-7-13-23(17-20)28-22-11-5-2-6-12-22/h1-13,17H,14-16,18H2,(H,25,27)
InChIKeyGYXROULLZFDTTL-UHFFFAOYSA-N
MW373.45 g/mol
LogP4.69
Rot. Bonds9

About N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide

N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide (PubChem CID 58543320) has the molecular formula C24H23NO3 and a molecular weight of 373.45 g/mol. Its IUPAC name is N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide.

Molecular Properties

Compound NameN-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide
PubChem CID58543320
Molecular FormulaC24H23NO3
Molecular Weight373.45 g/mol
Exact Mass373.17
IUPAC NameN-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide
SMILESO=C(CCC(=O)NCc1ccccc1)Cc1cccc(Oc2ccccc2)c1
InChIInChI=1S/C24H23NO3/c26-21(14-15-24(27)25-18-19-8-3-1-4-9-19)16-20-10-7-13-23(17-20)28-22-11-5-2-6-12-22/h1-13,17H,14-16,18H2,(H,25,27)
InChIKeyGYXROULLZFDTTL-UHFFFAOYSA-N
XLogP4.69
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.45
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide 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

CID 174876749
CID 174876749
N-[(4-phenoxyphenyl)methyl]butanamide
CID 155214759
1-[[4-(aminomethyl)phenyl]methyl]-3-[(3-phenoxyphenyl)methyl]urea
CID 68878464
2-(3-phenoxyphenyl)-N-(trifluoromethyl)acetamide
CID 174660546
2-(3-phenoxyphenyl)acetyl chloride
CID 12940116
2-[[2-(3-phenoxyphenyl)acetyl]amino]propanoic acid
CID 162228691
2-[2-oxo-3-(3-phenoxyphenyl)propyl]-1,2-benzothiazol-3-one
CID 58466358
3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-[(3-phenoxyphenyl)methyl]propanamide
CID 55688806
(4R)-4-morpholin-4-yl-N-[(3-phenoxyphenyl)methyl]pentanamide
CID 125164955
3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(3-phenoxyphenyl)methyl]propanamide
CID 39576535
N'-benzylbutanediamide
CID 4682951
N-(3-methylphenyl)-2-(3-phenoxyphenyl)acetamide
CID 59014791

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide?
The IUPAC name of N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide (CID 58543320) is N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide.
What is the SMILES notation for N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide?
The canonical SMILES for N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide is O=C(CCC(=O)NCc1ccccc1)Cc1cccc(Oc2ccccc2)c1.
What is the InChIKey of N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide?
The InChIKey is GYXROULLZFDTTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO3/c26-21(14-15-24(27)25-18-19-8-3-1-4-9-19)16-20-10-7-13-23(17-20)28-22-11-5-2-6-12-22/h1-13,17H,14-16,18H2,(H,25,27).
What are the key properties of N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide?
N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide has a molecular weight of 373.45 g/mol, XLogP of 4.69, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-oxo-5-(3-phenoxyphenyl)pentanamide is sourced from PubChem (CID 58543320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).