3-amino-N-(4-benzylphenyl)indazole-1-carboxamide

C21H18N4O — CID 25197651

IUPAC3-amino-N-(4-benzylphenyl)indazole-1-carboxamide
SMILESNc1nn(C(=O)Nc2ccc(Cc3ccccc3)cc2)c2ccccc12
InChIInChI=1S/C21H18N4O/c22-20-18-8-4-5-9-19(18)25(24-20)21(26)23-17-12-10-16(11-13-17)14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,22,24)(H,23,26)
InChIKeyUVRJXHGTVBSXBO-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.29
Rot. Bonds3

About 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide

3-amino-N-(4-benzylphenyl)indazole-1-carboxamide (PubChem CID 25197651) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-benzylphenyl)indazole-1-carboxamide
PubChem CID25197651
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC Name3-amino-N-(4-benzylphenyl)indazole-1-carboxamide
SMILESNc1nn(C(=O)Nc2ccc(Cc3ccccc3)cc2)c2ccccc12
InChIInChI=1S/C21H18N4O/c22-20-18-8-4-5-9-19(18)25(24-20)21(26)23-17-12-10-16(11-13-17)14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,22,24)(H,23,26)
InChIKeyUVRJXHGTVBSXBO-UHFFFAOYSA-N
XLogP4.29
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(4-benzylphenyl)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

Related Compounds

Linifanib
CID 11485656
3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-naphthalen-1-ylurea
CID 23646852
2-p-Tolyl-6H-pyrazolo[1,5-c]quinazolin-5-one
CID 135504122
N-[4-(5-amino-1-phenylpyrazol-3-yl)phenyl]acetamide
CID 2118092
N-[4-(dimethylamino)-1-methyl-1H-indazol-3-yl]-N'-phenylurea
CID 2812681
N-(2,4-dimethylphenyl)-4-methyl-1H-indazole-1-carboxamide
CID 16016793
1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea
CID 11154134
N-[4-(3-amino-1-methyl-1H-indazol-4-yl)-phenyl]-N''-(3-methylphenyl)urea
CID 11176194
1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(3-bromophenyl)urea
CID 11177668
1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-phenylurea
CID 11244819
1-(4-(3-amino-7-fluoro-1H-indazol-4-yl)phenyl)-3-m-tolylurea
CID 11245809
1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(3-ethylphenyl)urea
CID 11268741

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide?
The IUPAC name of 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide (CID 25197651) is 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide.
What is the SMILES notation for 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide?
The canonical SMILES for 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide is Nc1nn(C(=O)Nc2ccc(Cc3ccccc3)cc2)c2ccccc12.
What is the InChIKey of 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide?
The InChIKey is UVRJXHGTVBSXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c22-20-18-8-4-5-9-19(18)25(24-20)21(26)23-17-12-10-16(11-13-17)14-15-6-2-1-3-7-15/h1-13H,14H2,(H2,22,24)(H,23,26).
What are the key properties of 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide?
3-amino-N-(4-benzylphenyl)indazole-1-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 4.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-benzylphenyl)indazole-1-carboxamide is sourced from PubChem (CID 25197651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).