4-amino-2-chloro-5-methoxy-N-phenylbenzamide

C14H13ClN2O2 — CID 66664690

IUPAC4-amino-2-chloro-5-methoxy-N-phenylbenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2)c(Cl)cc1N
InChIInChI=1S/C14H13ClN2O2/c1-19-13-7-10(11(15)8-12(13)16)14(18)17-9-5-3-2-4-6-9/h2-8H,16H2,1H3,(H,17,18)
InChIKeyWFUNCADYNINKKV-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.18
Rot. Bonds3

About 4-amino-2-chloro-5-methoxy-N-phenylbenzamide

4-amino-2-chloro-5-methoxy-N-phenylbenzamide (PubChem CID 66664690) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 4-amino-2-chloro-5-methoxy-N-phenylbenzamide.

Molecular Properties

Compound Name4-amino-2-chloro-5-methoxy-N-phenylbenzamide
PubChem CID66664690
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name4-amino-2-chloro-5-methoxy-N-phenylbenzamide
SMILESCOc1cc(C(=O)Nc2ccccc2)c(Cl)cc1N
InChIInChI=1S/C14H13ClN2O2/c1-19-13-7-10(11(15)8-12(13)16)14(18)17-9-5-3-2-4-6-9/h2-8H,16H2,1H3,(H,17,18)
InChIKeyWFUNCADYNINKKV-UHFFFAOYSA-N
XLogP3.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-amino-2-chloro-5-methoxy-N-phenylbenzamide 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-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
CID 23464385
1-(4-amino-2-chloro-5-methoxyphenyl)ethanone
CID 53402810
N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide
CID 70635725
N-(3-amino-4-methoxyphenyl)-2-chloro-5-methylsulfanylbenzamide
CID 61379591
N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928
4-[(2-chloroacetyl)amino]-2,5-dimethoxy-N-phenylbenzamide
CID 18804059
[3-methoxy-4-(phenylcarbamoyl)phenyl]boronic acid
CID 22346905
N-(3-amino-4-methoxyphenyl)-5-(tert-butylcarbamoylamino)-2-chlorobenzamide
CID 119419296
N-(4-amino-3-methoxyphenyl)-2-bromobenzamide
CID 61240435
4-methoxy-2-methyl-N-phenyl-5-propan-2-ylbenzamide
CID 83407606
N-[2-chloro-5-(phenylcarbamoyl)phenyl]-3-methoxynaphthalene-2-carboxamide
CID 2268765
4-amino-2-chloro-N-(4-methoxyphenyl)benzamide
CID 16792666

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-chloro-5-methoxy-N-phenylbenzamide?
The IUPAC name of 4-amino-2-chloro-5-methoxy-N-phenylbenzamide (CID 66664690) is 4-amino-2-chloro-5-methoxy-N-phenylbenzamide.
What is the SMILES notation for 4-amino-2-chloro-5-methoxy-N-phenylbenzamide?
The canonical SMILES for 4-amino-2-chloro-5-methoxy-N-phenylbenzamide is COc1cc(C(=O)Nc2ccccc2)c(Cl)cc1N.
What is the InChIKey of 4-amino-2-chloro-5-methoxy-N-phenylbenzamide?
The InChIKey is WFUNCADYNINKKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-19-13-7-10(11(15)8-12(13)16)14(18)17-9-5-3-2-4-6-9/h2-8H,16H2,1H3,(H,17,18).
What are the key properties of 4-amino-2-chloro-5-methoxy-N-phenylbenzamide?
4-amino-2-chloro-5-methoxy-N-phenylbenzamide has a molecular weight of 276.72 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-chloro-5-methoxy-N-phenylbenzamide is sourced from PubChem (CID 66664690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).