2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide

C19H22ClNO — CID 100633604

IUPAC2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide
SMILESCC[C@@H](NC(=O)Cc1ccccc1Cl)c1ccc(C)c(C)c1
InChIInChI=1S/C19H22ClNO/c1-4-18(16-10-9-13(2)14(3)11-16)21-19(22)12-15-7-5-6-8-17(15)20/h5-11,18H,4,12H2,1-3H3,(H,21,22)/t18-/m1/s1
InChIKeyOHFZNSPNAIEXAK-GOSISDBHSA-N
MW315.84 g/mol
LogP4.77
Rot. Bonds5

About 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide

2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide (PubChem CID 100633604) has the molecular formula C19H22ClNO and a molecular weight of 315.84 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide
PubChem CID100633604
Molecular FormulaC19H22ClNO
Molecular Weight315.84 g/mol
Exact Mass315.14
IUPAC Name2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide
SMILESCC[C@@H](NC(=O)Cc1ccccc1Cl)c1ccc(C)c(C)c1
InChIInChI=1S/C19H22ClNO/c1-4-18(16-10-9-13(2)14(3)11-16)21-19(22)12-15-7-5-6-8-17(15)20/h5-11,18H,4,12H2,1-3H3,(H,21,22)/t18-/m1/s1
InChIKeyOHFZNSPNAIEXAK-GOSISDBHSA-N
XLogP4.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.84
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chlorophenyl)-N-(1-phenylpropyl)acetamide
CID 17328141
2-(4-chloro-2-fluorophenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 133161430
2-(2,4-dimethylphenyl)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 133202118
N-[1-(3,4-dimethylphenyl)propyl]-3-naphthalen-1-ylpropanamide
CID 132652663
2-(4-chlorophenoxy)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 132651553
2-(4-chlorophenoxy)-N-[1-(3,4-dimethylphenyl)propyl]butanamide
CID 132654231
2-(3,4-dimethylphenyl)-N-[1-(4-methylphenyl)propyl]acetamide
CID 132760177
2-(2-chloro-N-(4-methylphenyl)sulfonylanilino)-N-[1-(3,4-dimethylphenyl)propyl]acetamide
CID 43893986
N-[1-(4-chlorophenyl)propyl]-2-(2-fluorophenyl)acetamide
CID 18158661
4-chloro-N-[(1S)-1-(3,4-dimethylphenyl)propyl]benzamide
CID 99994348
2,4-dichloro-N-[1-(3,4-dimethylphenyl)propyl]benzamide
CID 132651752
2-(4-chlorophenyl)-N-[1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 133162635

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide (CID 100633604) is 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide is CC[C@@H](NC(=O)Cc1ccccc1Cl)c1ccc(C)c(C)c1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide?
The InChIKey is OHFZNSPNAIEXAK-GOSISDBHSA-N. The full InChI is InChI=1S/C19H22ClNO/c1-4-18(16-10-9-13(2)14(3)11-16)21-19(22)12-15-7-5-6-8-17(15)20/h5-11,18H,4,12H2,1-3H3,(H,21,22)/t18-/m1/s1.
What are the key properties of 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide?
2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide has a molecular weight of 315.84 g/mol, XLogP of 4.77, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[(1R)-1-(3,4-dimethylphenyl)propyl]acetamide is sourced from PubChem (CID 100633604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).