2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide

C14H11ClN2O4 — CID 4639208

IUPAC2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C14H11ClN2O4/c15-10-3-1-9(2-4-10)7-14(19)16-12-8-11(17(20)21)5-6-13(12)18/h1-6,8,18H,7H2,(H,16,19)
InChIKeyVRTHYTIBPIEHSF-UHFFFAOYSA-N
MW306.70 g/mol
LogP3.13
Rot. Bonds4

About 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide

2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide (PubChem CID 4639208) has the molecular formula C14H11ClN2O4 and a molecular weight of 306.70 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
PubChem CID4639208
Molecular FormulaC14H11ClN2O4
Molecular Weight306.70 g/mol
Exact Mass306.04
IUPAC Name2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1O
InChIInChI=1S/C14H11ClN2O4/c15-10-3-1-9(2-4-10)7-14(19)16-12-8-11(17(20)21)5-6-13(12)18/h1-6,8,18H,7H2,(H,16,19)
InChIKeyVRTHYTIBPIEHSF-UHFFFAOYSA-N
XLogP3.13
TPSA92.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.70
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide 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

N-(2-chloro-5-nitrophenyl)-2-(4-chlorophenyl)acetamide
CID 4048119
2-(2,4-dichlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 112771738
N-(5-chloro-2-hydroxyphenyl)-2-(4-chlorophenyl)acetamide
CID 1262869
2-(2-fluorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 103602366
2-(4-chlorophenyl)-N-(2-methoxy-4-nitrophenyl)acetamide
CID 2892197
3-amino-N-(2-hydroxy-5-nitrophenyl)propanamide
CID 107744574
2-bromo-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 4089912
2-(3-bromophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide
CID 103894337
N-(2-hydroxy-5-nitrophenyl)-2-(3-methylphenyl)acetamide
CID 103863285
N-(2-hydroxy-4-nitrophenyl)-2-(4-hydroxyphenyl)acetamide
CID 107745071
N-(2-chloro-5-nitrophenyl)-2-(4-methylphenyl)acetamide
CID 889214
4-chloro-2-[[2-(4-nitrophenyl)acetyl]amino]benzoate
CID 7372821

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide (CID 4639208) is 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1O.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
The InChIKey is VRTHYTIBPIEHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O4/c15-10-3-1-9(2-4-10)7-14(19)16-12-8-11(17(20)21)5-6-13(12)18/h1-6,8,18H,7H2,(H,16,19).
What are the key properties of 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide?
2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide has a molecular weight of 306.70 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2-hydroxy-5-nitrophenyl)acetamide is sourced from PubChem (CID 4639208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).