2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide

C15H14N4O2 — CID 115412694

IUPAC2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc3cn[nH]c23)c(N)c1
InChIInChI=1S/C15H14N4O2/c1-21-10-5-6-11(12(16)7-10)15(20)18-13-4-2-3-9-8-17-19-14(9)13/h2-8H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyKPAIFKIGJUAMJC-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.41
Rot. Bonds3

About 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide

2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide (PubChem CID 115412694) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide
PubChem CID115412694
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc3cn[nH]c23)c(N)c1
InChIInChI=1S/C15H14N4O2/c1-21-10-5-6-11(12(16)7-10)15(20)18-13-4-2-3-9-8-17-19-14(9)13/h2-8H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyKPAIFKIGJUAMJC-UHFFFAOYSA-N
XLogP2.41
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-N-(1H-indazol-7-yl)-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

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide?
The IUPAC name of 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide (CID 115412694) is 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide.
What is the SMILES notation for 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide?
The canonical SMILES for 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2cccc3cn[nH]c23)c(N)c1.
What is the InChIKey of 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide?
The InChIKey is KPAIFKIGJUAMJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-10-5-6-11(12(16)7-10)15(20)18-13-4-2-3-9-8-17-19-14(9)13/h2-8H,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide?
2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide has a molecular weight of 282.30 g/mol, XLogP of 2.41, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1H-indazol-7-yl)-4-methoxybenzamide is sourced from PubChem (CID 115412694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).