2-amino-4-(6-methoxy-3-pyridinyl)benzamide

C13H13N3O2 — CID 143786291

IUPAC2-amino-4-(6-methoxy-3-pyridinyl)benzamide
SMILESCOc1ccc(-c2ccc(C(N)=O)c(N)c2)cn1
InChIInChI=1S/C13H13N3O2/c1-18-12-5-3-9(7-16-12)8-2-4-10(13(15)17)11(14)6-8/h2-7H,14H2,1H3,(H2,15,17)
InChIKeyGKJCBKRICYGZES-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.44
Rot. Bonds3

About 2-amino-4-(6-methoxy-3-pyridinyl)benzamide

2-amino-4-(6-methoxy-3-pyridinyl)benzamide (PubChem CID 143786291) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 2-amino-4-(6-methoxy-3-pyridinyl)benzamide.

Molecular Properties

Compound Name2-amino-4-(6-methoxy-3-pyridinyl)benzamide
PubChem CID143786291
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name2-amino-4-(6-methoxy-3-pyridinyl)benzamide
SMILESCOc1ccc(-c2ccc(C(N)=O)c(N)c2)cn1
InChIInChI=1S/C13H13N3O2/c1-18-12-5-3-9(7-16-12)8-2-4-10(13(15)17)11(14)6-8/h2-7H,14H2,1H3,(H2,15,17)
InChIKeyGKJCBKRICYGZES-UHFFFAOYSA-N
XLogP1.44
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-4-(6-methoxy-3-pyridinyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(6-methoxy-3-pyridinyl)benzamide?
The IUPAC name of 2-amino-4-(6-methoxy-3-pyridinyl)benzamide (CID 143786291) is 2-amino-4-(6-methoxy-3-pyridinyl)benzamide.
What is the SMILES notation for 2-amino-4-(6-methoxy-3-pyridinyl)benzamide?
The canonical SMILES for 2-amino-4-(6-methoxy-3-pyridinyl)benzamide is COc1ccc(-c2ccc(C(N)=O)c(N)c2)cn1.
What is the InChIKey of 2-amino-4-(6-methoxy-3-pyridinyl)benzamide?
The InChIKey is GKJCBKRICYGZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c1-18-12-5-3-9(7-16-12)8-2-4-10(13(15)17)11(14)6-8/h2-7H,14H2,1H3,(H2,15,17).
What are the key properties of 2-amino-4-(6-methoxy-3-pyridinyl)benzamide?
2-amino-4-(6-methoxy-3-pyridinyl)benzamide has a molecular weight of 243.27 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(6-methoxy-3-pyridinyl)benzamide is sourced from PubChem (CID 143786291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).