2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide

C14H12ClN3O4 — CID 141373266

IUPAC2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide
SMILESCOc1ccc([N+](=O)[O-])c(NC(=O)Cc2ccccc2Cl)n1
InChIInChI=1S/C14H12ClN3O4/c1-22-13-7-6-11(18(20)21)14(17-13)16-12(19)8-9-4-2-3-5-10(9)15/h2-7H,8H2,1H3,(H,16,17,19)
InChIKeyYJBHLFGDXJAXRA-UHFFFAOYSA-N
MW321.72 g/mol
LogP2.83
Rot. Bonds5

About 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide

2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide (PubChem CID 141373266) has the molecular formula C14H12ClN3O4 and a molecular weight of 321.72 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide
PubChem CID141373266
Molecular FormulaC14H12ClN3O4
Molecular Weight321.72 g/mol
Exact Mass321.05
IUPAC Name2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide
SMILESCOc1ccc([N+](=O)[O-])c(NC(=O)Cc2ccccc2Cl)n1
InChIInChI=1S/C14H12ClN3O4/c1-22-13-7-6-11(18(20)21)14(17-13)16-12(19)8-9-4-2-3-5-10(9)15/h2-7H,8H2,1H3,(H,16,17,19)
InChIKeyYJBHLFGDXJAXRA-UHFFFAOYSA-N
XLogP2.83
TPSA94.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.72
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)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-(6-methoxy-3-nitro-2-pyridinyl)pentanamide
CID 19759381
N-(6-chloro-3-nitro-2-pyridinyl)-2-(2-hydroxyphenyl)acetamide
CID 104820323
6-methoxy-N-[(2-methoxyphenyl)methyl]-3-nitropyridin-2-amine
CID 79881497
3-[(6-methoxy-3-nitro-2-pyridinyl)amino]-N-methylpropanamide
CID 113286774
N-ethyl-2-[(6-methoxy-3-nitro-2-pyridinyl)amino]acetamide
CID 115321441
N-[(3-ethyl-2-pyridinyl)methyl]-6-methoxy-3-nitropyridin-2-amine
CID 82736234
N-(6-chloro-3-nitro-2-pyridinyl)-3-methoxypropanamide
CID 104820229
N-[2-[(6-methoxy-3-nitro-2-pyridinyl)amino]ethyl]acetamide
CID 22141713
N-[(5-chlorothiophen-2-yl)methyl]-6-methoxy-3-nitropyridin-2-amine
CID 79883840
2-(2-chlorophenyl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]acetamide
CID 24517004
methyl 2-(6-methoxy-3-nitro-2-pyridinyl)acetate
CID 12036409
N,N'-bis(6-methoxy-3-nitro-2-pyridinyl)heptane-1,7-diamine
CID 110172492

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide (CID 141373266) is 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide is COc1ccc([N+](=O)[O-])c(NC(=O)Cc2ccccc2Cl)n1.
What is the InChIKey of 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide?
The InChIKey is YJBHLFGDXJAXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O4/c1-22-13-7-6-11(18(20)21)14(17-13)16-12(19)8-9-4-2-3-5-10(9)15/h2-7H,8H2,1H3,(H,16,17,19).
What are the key properties of 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide?
2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide has a molecular weight of 321.72 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-(6-methoxy-3-nitro-2-pyridinyl)acetamide is sourced from PubChem (CID 141373266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).