N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide

C15H12BrN3O — CID 62062398

IUPACN-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide
SMILESO=C(NCc1ccccc1Br)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H12BrN3O/c16-13-4-2-1-3-11(13)8-17-15(20)10-5-6-12-9-18-19-14(12)7-10/h1-7,9H,8H2,(H,17,20)(H,18,19)
InChIKeyPUFQIGSQBJIAKV-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.26
Rot. Bonds3

About N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide

N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide (PubChem CID 62062398) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide
PubChem CID62062398
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC NameN-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide
SMILESO=C(NCc1ccccc1Br)c1ccc2cn[nH]c2c1
InChIInChI=1S/C15H12BrN3O/c16-13-4-2-1-3-11(13)8-17-15(20)10-5-6-12-9-18-19-14(12)7-10/h1-7,9H,8H2,(H,17,20)(H,18,19)
InChIKeyPUFQIGSQBJIAKV-UHFFFAOYSA-N
XLogP3.26
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(2-bromophenyl)methyl]-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-[(5-bromo-2-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 46341642
N-[(2,5-difluorophenyl)methyl]-1H-indazole-6-carboxamide
CID 63379684
N-(1,3-thiazol-2-ylmethyl)-1H-indazole-6-carboxamide
CID 62905804
N-[(4-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 46341632
N-[(2-bromophenyl)methyl]-3,4-dimethylbenzamide
CID 60739135
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)-1H-indazole-6-carboxamide
CID 114693720
N-[(5-methylthiophen-2-yl)methyl]-1H-indazole-6-carboxamide
CID 61242487
N-(2-hydroxy-2-phenylethyl)-1H-indazole-6-carboxamide
CID 43394671
N-(3-aminobutyl)-1H-indazole-6-carboxamide
CID 63253437
N-(3,3,3-trifluoropropyl)-1H-indazole-6-carboxamide
CID 63227826
2-hydroxy-3-(1H-indazole-6-carbonylamino)propanoic acid
CID 66166001
N-[(2-bromophenyl)methyl]-5-hydroxypyridine-3-carboxamide
CID 63852378

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide?
The IUPAC name of N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide (CID 62062398) is N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide?
The canonical SMILES for N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide is O=C(NCc1ccccc1Br)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide?
The InChIKey is PUFQIGSQBJIAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c16-13-4-2-1-3-11(13)8-17-15(20)10-5-6-12-9-18-19-14(12)7-10/h1-7,9H,8H2,(H,17,20)(H,18,19).
What are the key properties of N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide?
N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide has a molecular weight of 330.19 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-1H-indazole-6-carboxamide is sourced from PubChem (CID 62062398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).