(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide

C19H20ClNO2 — CID 879686

IUPAC(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide
SMILESCCC[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C19H20ClNO2/c1-3-7-13(2)19(23)21-17-11-10-15(20)12-16(17)18(22)14-8-5-4-6-9-14/h4-6,8-13H,3,7H2,1-2H3,(H,21,23)/t13-/m1/s1
InChIKeyUDAYKGQFPPCRNU-CYBMUJFWSA-N
MW329.83 g/mol
LogP4.95
Rot. Bonds6

About (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide

(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide (PubChem CID 879686) has the molecular formula C19H20ClNO2 and a molecular weight of 329.83 g/mol. Its IUPAC name is (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide.

Molecular Properties

Compound Name(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide
PubChem CID879686
Molecular FormulaC19H20ClNO2
Molecular Weight329.83 g/mol
Exact Mass329.12
IUPAC Name(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide
SMILESCCC[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIInChI=1S/C19H20ClNO2/c1-3-7-13(2)19(23)21-17-11-10-15(20)12-16(17)18(22)14-8-5-4-6-9-14/h4-6,8-13H,3,7H2,1-2H3,(H,21,23)/t13-/m1/s1
InChIKeyUDAYKGQFPPCRNU-CYBMUJFWSA-N
XLogP4.95
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.83
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(2,4-dichlorophenyl)-2-methylpentanamide
CID 884870
2-amino-N-(2-benzoyl-4-chlorophenyl)-2-fluoroacetamide
CID 23332701
N-(2-benzoyl-4-chlorophenyl)-2-[4-(2-methylpropyl)phenyl]propanamide
CID 11839494
tert-butyl N-[1-(2-benzoyl-4-chloroanilino)-1-oxobutan-2-yl]carbamate
CID 139414140
N-(2-benzoyl-4-chlorophenyl)-2-iodoacetamide
CID 12500538
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782592
(2R)-N-(2-benzoyl-4-chlorophenyl)-2-(3,4-dimethylphenoxy)butanamide
CID 92681200
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]-diethylazanium
CID 5113102
2-[(3-amino-2-methylpropanoyl)amino]-5-chlorobenzoic acid
CID 55104752
N-(2-amino-5-chlorophenyl)-2-methylpentanamide
CID 43209694
N-(2-bromo-5-chlorophenyl)-2-methylpentanamide
CID 81272725
(2S)-N-(2-benzoyl-4-chlorophenyl)-2-(3-methoxyphenoxy)butanamide
CID 99952036

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide?
The IUPAC name of (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide (CID 879686) is (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide.
What is the SMILES notation for (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide?
The canonical SMILES for (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide is CCC[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1.
What is the InChIKey of (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide?
The InChIKey is UDAYKGQFPPCRNU-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H20ClNO2/c1-3-7-13(2)19(23)21-17-11-10-15(20)12-16(17)18(22)14-8-5-4-6-9-14/h4-6,8-13H,3,7H2,1-2H3,(H,21,23)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide?
(2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide has a molecular weight of 329.83 g/mol, XLogP of 4.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-benzoyl-4-chlorophenyl)-2-methylpentanamide is sourced from PubChem (CID 879686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).