3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide

C15H15ClN2O3 — CID 107620662

IUPAC3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)c(OC)c2)cc1N
InChIInChI=1S/C15H15ClN2O3/c1-20-13-6-3-9(7-12(13)17)15(19)18-10-4-5-11(16)14(8-10)21-2/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyUNSKNLAOWSTQFC-UHFFFAOYSA-N
MW306.75 g/mol
LogP3.19
Rot. Bonds4

About 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide

3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide (PubChem CID 107620662) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide
PubChem CID107620662
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Cl)c(OC)c2)cc1N
InChIInChI=1S/C15H15ClN2O3/c1-20-13-6-3-9(7-12(13)17)15(19)18-10-4-5-11(16)14(8-10)21-2/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyUNSKNLAOWSTQFC-UHFFFAOYSA-N
XLogP3.19
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide 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

3-amino-N-(4-chloro-3-fluorophenyl)-4-methoxybenzamide
CID 61466446
3-amino-N-(4-bromo-3-chlorophenyl)-4-methoxybenzamide
CID 107618351
N-(3-amino-4-methoxyphenyl)-3-bromo-4-chlorobenzamide
CID 107990051
N-(4-chloro-3-methoxyphenyl)-4-(methylamino)benzamide
CID 107623041
4-bromo-N-(4-chloro-3-methoxyphenyl)benzamide
CID 107271772
N-(3-amino-4-methoxyphenyl)-4-hydroxybenzamide
CID 43599919
3-amino-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 16785828
3-amino-N-(3,4-dimethoxyphenyl)-4-fluorobenzamide
CID 39395082
4-amino-3-chloro-N-(4-fluoro-3-methoxyphenyl)benzamide
CID 114836867
N-(3-amino-4-chlorophenyl)-4-fluoro-3-methoxybenzamide
CID 81283716
3-amino-N-(3-chloro-5-fluorophenyl)-4-methoxybenzamide
CID 107363446
N-(3-amino-4-methoxyphenyl)-4-tert-butylbenzamide
CID 18524942

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide?
The IUPAC name of 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide (CID 107620662) is 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide?
The canonical SMILES for 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(Cl)c(OC)c2)cc1N.
What is the InChIKey of 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide?
The InChIKey is UNSKNLAOWSTQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c1-20-13-6-3-9(7-12(13)17)15(19)18-10-4-5-11(16)14(8-10)21-2/h3-8H,17H2,1-2H3,(H,18,19).
What are the key properties of 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide?
3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide has a molecular weight of 306.75 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 107620662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).