(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide

C15H13ClN2O3 — CID 895147

IUPAC(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H13ClN2O3/c1-10(11-6-8-12(9-7-11)18(20)21)15(19)17-14-5-3-2-4-13(14)16/h2-10H,1H3,(H,17,19)/t10-/m1/s1
InChIKeyLWVFIFVLSBRVKD-SNVBAGLBSA-N
MW304.73 g/mol
LogP3.99
Rot. Bonds4

About (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide

(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide (PubChem CID 895147) has the molecular formula C15H13ClN2O3 and a molecular weight of 304.73 g/mol. Its IUPAC name is (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide
PubChem CID895147
Molecular FormulaC15H13ClN2O3
Molecular Weight304.73 g/mol
Exact Mass304.06
IUPAC Name(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C15H13ClN2O3/c1-10(11-6-8-12(9-7-11)18(20)21)15(19)17-14-5-3-2-4-13(14)16/h2-10H,1H3,(H,17,19)/t10-/m1/s1
InChIKeyLWVFIFVLSBRVKD-SNVBAGLBSA-N
XLogP3.99
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.73
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-(2-bromophenyl)-2-(4-nitrophenyl)propanamide
CID 895338
N-(2-cyanophenyl)-2-(4-nitrophenyl)propanamide
CID 2944727
N-(2-chlorophenyl)-2-phenylpropanamide
CID 70678301
N-[(2-chlorophenyl)methyl]-2-(4-nitrophenyl)propanamide
CID 2943745
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(4-nitrophenyl)propanamide
CID 2944518
(2S)-2-(4-nitrophenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 895294
N'-(2-chlorophenyl)-N-(4-nitrophenyl)oxamide
CID 108500250
1-(2-chlorophenyl)-3-[2-(4-nitrophenyl)sulfanylphenyl]urea
CID 18431132
1-(2-chlorophenyl)-3-[(4-nitrobenzoyl)amino]urea
CID 4850582
(2R)-N-(2,3-dichlorophenyl)-2-phenylpropanamide
CID 97038158
(2S)-N-(2-chlorophenyl)-2-(2-methoxy-5-nitrophenoxy)propanamide
CID 8947062
(2S)-N-(2-methoxy-5-nitrophenyl)-2-phenylpropanamide
CID 897896

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide?
The IUPAC name of (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide (CID 895147) is (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide.
What is the SMILES notation for (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide?
The canonical SMILES for (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide is C[C@@H](C(=O)Nc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1.
What is the InChIKey of (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide?
The InChIKey is LWVFIFVLSBRVKD-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H13ClN2O3/c1-10(11-6-8-12(9-7-11)18(20)21)15(19)17-14-5-3-2-4-13(14)16/h2-10H,1H3,(H,17,19)/t10-/m1/s1.
What are the key properties of (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide?
(2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide has a molecular weight of 304.73 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-chlorophenyl)-2-(4-nitrophenyl)propanamide is sourced from PubChem (CID 895147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).