N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide

C15H12ClN3O — CID 60715106

IUPACN-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3cn[nH]c3c2)c(Cl)c1
InChIInChI=1S/C15H12ClN3O/c1-9-2-5-13(12(16)6-9)18-15(20)10-3-4-11-8-17-19-14(11)7-10/h2-8H,1H3,(H,17,19)(H,18,20)
InChIKeyNVUHJZXARSHWCB-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.78
Rot. Bonds2

About N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide

N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide (PubChem CID 60715106) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide
PubChem CID60715106
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC NameN-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3cn[nH]c3c2)c(Cl)c1
InChIInChI=1S/C15H12ClN3O/c1-9-2-5-13(12(16)6-9)18-15(20)10-3-4-11-8-17-19-14(11)7-10/h2-8H,1H3,(H,17,19)(H,18,20)
InChIKeyNVUHJZXARSHWCB-UHFFFAOYSA-N
XLogP3.78
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide 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-(2,4-dichlorophenyl)-1H-indazole-6-carboxamide
CID 60715317
N-(5-bromo-2-chlorophenyl)-1H-indazole-6-carboxamide
CID 62909267
N-(5-bromo-2-methylphenyl)-1H-indazole-6-carboxamide
CID 62921443
N-(4-bromo-2-fluorophenyl)-1H-indazole-6-carboxamide
CID 60716242
N-(3,5-dichlorophenyl)-1H-indazole-6-carboxamide
CID 60714993
N-(2-acetylphenyl)-1H-indazole-6-carboxamide
CID 110485418
N-(5-cyano-2-methylphenyl)-1H-indazole-6-carboxamide
CID 62907539
N-(6-methyl-2-pyridinyl)-1H-indazole-6-carboxamide
CID 55023758
N-(2-bromo-4-fluorophenyl)-1H-indazole-6-carboxamide
CID 62919566
N-(1H-indazol-6-yl)-3,5-dimethylbenzamide
CID 36560760
3-amino-4-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967462
N-(2,5-dimethylpyrazol-3-yl)-1H-indazole-6-carboxamide
CID 62907185

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide (CID 60715106) is N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide is Cc1ccc(NC(=O)c2ccc3cn[nH]c3c2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide?
The InChIKey is NVUHJZXARSHWCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c1-9-2-5-13(12(16)6-9)18-15(20)10-3-4-11-8-17-19-14(11)7-10/h2-8H,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide?
N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide has a molecular weight of 285.73 g/mol, XLogP of 3.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 60715106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).