2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide

C15H15ClN2O2 — CID 28712195

IUPAC2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(N)c2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-20-14-6-5-12(9-13(14)16)18-15(19)8-10-3-2-4-11(17)7-10/h2-7,9H,8,17H2,1H3,(H,18,19)
InChIKeyXOPXKZXWAYFPPH-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.11
Rot. Bonds4

About 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide

2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide (PubChem CID 28712195) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide
PubChem CID28712195
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2cccc(N)c2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-20-14-6-5-12(9-13(14)16)18-15(19)8-10-3-2-4-11(17)7-10/h2-7,9H,8,17H2,1H3,(H,18,19)
InChIKeyXOPXKZXWAYFPPH-UHFFFAOYSA-N
XLogP3.11
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-aminophenyl)-N-(4-bromo-3-methoxyphenyl)acetamide
CID 82862923
N-(3-chloro-4-methoxyphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 7934876
[2-(3-chloro-4-methoxyanilino)-2-oxoethyl] 2-(3-fluorophenyl)acetate
CID 8590459
2-(3-aminophenyl)-N-(3,5-dichloro-4-fluorophenyl)acetamide
CID 107571211
N-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-2-phenylacetamide
CID 9468421
N-(3,4-dimethoxyphenyl)-2-(3-methylphenyl)acetamide
CID 9497409
2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide
CID 28712382
N,N'-bis(3-chloro-4-methoxyphenyl)hexanediamide
CID 4945268
2-(3-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 62499152
N-(3-chloro-4-methoxyphenyl)-2-(4-ethoxyphenyl)acetamide
CID 26823011
3-(3-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)propanamide
CID 43381050
2-(4-amino-1,2,5-oxadiazol-3-yl)-N-(3-chloro-4-methoxyphenyl)acetamide
CID 82358212

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide (CID 28712195) is 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cc2cccc(N)c2)cc1Cl.
What is the InChIKey of 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide?
The InChIKey is XOPXKZXWAYFPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-20-14-6-5-12(9-13(14)16)18-15(19)8-10-3-2-4-11(17)7-10/h2-7,9H,8,17H2,1H3,(H,18,19).
What are the key properties of 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide?
2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide is sourced from PubChem (CID 28712195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).