2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide

C16H15Cl2NO — CID 81352338

IUPAC2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide
SMILESC[C@@H](NC(=O)C(Cl)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C16H15Cl2NO/c1-11(12-7-9-14(17)10-8-12)19-16(20)15(18)13-5-3-2-4-6-13/h2-11,15H,1H3,(H,19,20)/t11-,15?/m1/s1
InChIKeyAGGCWXYMLMHDLI-ZRKZCGFPSA-N
MW308.21 g/mol
LogP4.50
Rot. Bonds4

About 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide

2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide (PubChem CID 81352338) has the molecular formula C16H15Cl2NO and a molecular weight of 308.21 g/mol. Its IUPAC name is 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide
PubChem CID81352338
Molecular FormulaC16H15Cl2NO
Molecular Weight308.21 g/mol
Exact Mass307.05
IUPAC Name2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide
SMILESC[C@@H](NC(=O)C(Cl)c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C16H15Cl2NO/c1-11(12-7-9-14(17)10-8-12)19-16(20)15(18)13-5-3-2-4-6-13/h2-11,15H,1H3,(H,19,20)/t11-,15?/m1/s1
InChIKeyAGGCWXYMLMHDLI-ZRKZCGFPSA-N
XLogP4.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.21
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide 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

(2R)-2-(4-chlorophenyl)-3-methyl-N-[(1S)-1-phenylethyl]butanamide
CID 7945468
(2S)-2-amino-N-[1-(4-chlorophenyl)ethyl]-2-phenylacetamide
CID 104897669
2,2-dichloro-N-(1-phenylethyl)acetamide
CID 2841890
2-chloro-N-[1-(4-chlorophenyl)propan-2-yl]-2-phenylacetamide
CID 43697058
[(1S)-1-(4-chlorophenyl)ethyl]carbamic acid
CID 155021809
(2R)-2-(4-chlorophenoxy)-N-[(1R)-1-phenylethyl]propanamide
CID 2094690
4-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498873
2-(4-chlorophenyl)sulfonyl-N-(1-phenylethyl)propanamide
CID 78761153
ethyl (2R)-2-[[(2S)-2-chloro-2-(4-chlorophenyl)acetyl]amino]-2-phenylacetate
CID 101040228
2-chloro-N-[(1S)-1-(furan-2-yl)ethyl]-2-phenylacetamide
CID 81400828
(2S)-2-amino-N-[(1S)-1-(4-chlorophenyl)ethyl]-3-phenylpropanamide
CID 81355557
2-chloro-N-[1-(3-methoxyphenyl)ethyl]-2-phenylacetamide
CID 60934244

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide?
The IUPAC name of 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide (CID 81352338) is 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide.
What is the SMILES notation for 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide?
The canonical SMILES for 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide is C[C@@H](NC(=O)C(Cl)c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide?
The InChIKey is AGGCWXYMLMHDLI-ZRKZCGFPSA-N. The full InChI is InChI=1S/C16H15Cl2NO/c1-11(12-7-9-14(17)10-8-12)19-16(20)15(18)13-5-3-2-4-6-13/h2-11,15H,1H3,(H,19,20)/t11-,15?/m1/s1.
What are the key properties of 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide?
2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide has a molecular weight of 308.21 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 81352338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).