3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide

C17H15ClF2N2O2 — CID 51271181

IUPAC3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cc(F)cc(F)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClF2N2O2/c1-10(23)21-16(11-2-4-12(18)5-3-11)9-17(24)22-15-7-13(19)6-14(20)8-15/h2-8,16H,9H2,1H3,(H,21,23)(H,22,24)
InChIKeyQYVDTMBTHHPFAW-UHFFFAOYSA-N
MW352.77 g/mol
LogP3.82
Rot. Bonds5

About 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide

3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide (PubChem CID 51271181) has the molecular formula C17H15ClF2N2O2 and a molecular weight of 352.77 g/mol. Its IUPAC name is 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide
PubChem CID51271181
Molecular FormulaC17H15ClF2N2O2
Molecular Weight352.77 g/mol
Exact Mass352.08
IUPAC Name3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cc(F)cc(F)c1)c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClF2N2O2/c1-10(23)21-16(11-2-4-12(18)5-3-11)9-17(24)22-15-7-13(19)6-14(20)8-15/h2-8,16H,9H2,1H3,(H,21,23)(H,22,24)
InChIKeyQYVDTMBTHHPFAW-UHFFFAOYSA-N
XLogP3.82
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.77
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide 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

3-acetamido-3-(4-chlorophenyl)-N-(4-methylphenyl)propanamide
CID 51194875
3-acetamido-3-(4-chlorophenyl)-N-(4-fluoro-2-methylphenyl)propanamide
CID 51195587
3-acetamido-N-(3,5-dichlorophenyl)-3-(4-methylphenyl)propanamide
CID 55377328
3-acetamido-3-(4-chlorophenyl)-N-[2-(3,4-difluoroanilino)-2-oxoethyl]propanamide
CID 55379526
3-acetamido-N-(3,4-difluorophenyl)-3-(4-methylphenyl)propanamide
CID 51195190
3-acetamido-3-(4-chlorophenyl)-N-(4-methoxyphenyl)propanamide
CID 46689011
3-acetamido-3-(4-chlorophenyl)-N-[4-(difluoromethoxy)phenyl]propanamide
CID 51195341
3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide
CID 51195326
3-acetamido-N-(4-chloro-2-fluorophenyl)-3-(4-methylphenyl)propanamide
CID 51195101
3-[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]-N-methylbenzamide
CID 46585410
3-acetamido-3-(4-chlorophenyl)-N-(3-cyanophenyl)propanamide
CID 51195259
N-[1-(4-chlorophenyl)-3-[2-[2-(4-fluorophenyl)acetyl]hydrazinyl]-3-oxopropyl]acetamide
CID 51195838

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide?
The IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide (CID 51271181) is 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide.
What is the SMILES notation for 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide?
The canonical SMILES for 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide is CC(=O)NC(CC(=O)Nc1cc(F)cc(F)c1)c1ccc(Cl)cc1.
What is the InChIKey of 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide?
The InChIKey is QYVDTMBTHHPFAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClF2N2O2/c1-10(23)21-16(11-2-4-12(18)5-3-11)9-17(24)22-15-7-13(19)6-14(20)8-15/h2-8,16H,9H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide?
3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide has a molecular weight of 352.77 g/mol, XLogP of 3.82, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide is sourced from PubChem (CID 51271181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).