5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide

C16H14ClN3O2 — CID 22510701

IUPAC5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)n1ncc2cc(Cl)ccc21
InChIInChI=1S/C16H14ClN3O2/c1-10-3-6-15(22-2)13(7-10)19-16(21)20-14-5-4-12(17)8-11(14)9-18-20/h3-9H,1-2H3,(H,19,21)
InChIKeyVZBMQRLLBOQZKP-UHFFFAOYSA-N
MW315.76 g/mol
LogP4.09
Rot. Bonds2

About 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide

5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide (PubChem CID 22510701) has the molecular formula C16H14ClN3O2 and a molecular weight of 315.76 g/mol. Its IUPAC name is 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide
PubChem CID22510701
Molecular FormulaC16H14ClN3O2
Molecular Weight315.76 g/mol
Exact Mass315.08
IUPAC Name5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)n1ncc2cc(Cl)ccc21
InChIInChI=1S/C16H14ClN3O2/c1-10-3-6-15(22-2)13(7-10)19-16(21)20-14-5-4-12(17)8-11(14)9-18-20/h3-9H,1-2H3,(H,19,21)
InChIKeyVZBMQRLLBOQZKP-UHFFFAOYSA-N
XLogP4.09
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide 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 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide?
The IUPAC name of 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide (CID 22510701) is 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide?
The canonical SMILES for 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide is COc1ccc(C)cc1NC(=O)n1ncc2cc(Cl)ccc21.
What is the InChIKey of 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide?
The InChIKey is VZBMQRLLBOQZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2/c1-10-3-6-15(22-2)13(7-10)19-16(21)20-14-5-4-12(17)8-11(14)9-18-20/h3-9H,1-2H3,(H,19,21).
What are the key properties of 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide?
5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide has a molecular weight of 315.76 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-methoxy-5-methylphenyl)indazole-1-carboxamide is sourced from PubChem (CID 22510701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).