3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide

C18H18Cl2N2O2 — CID 51195326

IUPAC3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cc(Cl)ccc1C)c1ccc(Cl)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-11-3-6-15(20)9-16(11)22-18(24)10-17(21-12(2)23)13-4-7-14(19)8-5-13/h3-9,17H,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyOUETWVCXVYGYIP-UHFFFAOYSA-N
MW365.26 g/mol
LogP4.51
Rot. Bonds5

About 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide

3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide (PubChem CID 51195326) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide.

Molecular Properties

Compound Name3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide
PubChem CID51195326
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC Name3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide
SMILESCC(=O)NC(CC(=O)Nc1cc(Cl)ccc1C)c1ccc(Cl)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-11-3-6-15(20)9-16(11)22-18(24)10-17(21-12(2)23)13-4-7-14(19)8-5-13/h3-9,17H,10H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyOUETWVCXVYGYIP-UHFFFAOYSA-N
XLogP4.51
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-acetamido-3-(4-chlorophenyl)-N-(2-methyl-5-methylsulfonylphenyl)propanamide
CID 42920159
3-acetamido-3-(4-chlorophenyl)-N-(4,5-dimethoxy-2-methylphenyl)propanamide
CID 51195428
3-acetamido-3-(4-chlorophenyl)-N-(4-fluoro-2-methylphenyl)propanamide
CID 51195587
3-acetamido-N-(4-chloro-2-fluorophenyl)-3-(4-methylphenyl)propanamide
CID 51195101
N-[(1S)-3-(5-chloro-2-methylanilino)-3-oxo-1-phenylpropyl]benzamide
CID 8502250
4-[[3-acetamido-3-(4-chlorophenyl)propanoyl]amino]-N,3-dimethylbenzamide
CID 55706071
3-acetamido-3-(4-chlorophenyl)-N-(4-methylphenyl)propanamide
CID 51194875
N-[3-[[3-acetamido-3-(4-methylphenyl)propanoyl]amino]-4-methylphenyl]-2-methylpropanamide
CID 55708659
3-acetamido-3-(4-chlorophenyl)-N-(3,5-difluorophenyl)propanamide
CID 51271181
(3R)-3-acetamido-N-(2-methylphenyl)-3-phenylpropanamide
CID 2599103
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
3-acetamido-N-(3,5-dichlorophenyl)-3-(4-methylphenyl)propanamide
CID 55377328

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide?
The IUPAC name of 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide (CID 51195326) is 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide.
What is the SMILES notation for 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide?
The canonical SMILES for 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide is CC(=O)NC(CC(=O)Nc1cc(Cl)ccc1C)c1ccc(Cl)cc1.
What is the InChIKey of 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide?
The InChIKey is OUETWVCXVYGYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-11-3-6-15(20)9-16(11)22-18(24)10-17(21-12(2)23)13-4-7-14(19)8-5-13/h3-9,17H,10H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide?
3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide has a molecular weight of 365.26 g/mol, XLogP of 4.51, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(5-chloro-2-methylphenyl)-3-(4-chlorophenyl)propanamide is sourced from PubChem (CID 51195326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).