N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide

C16H14FN3O — CID 22510428

IUPACN-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide
SMILESCc1ccc(NC(=O)n2ncc3c(C)cccc32)cc1F
InChIInChI=1S/C16H14FN3O/c1-10-4-3-5-15-13(10)9-18-20(15)16(21)19-12-7-6-11(2)14(17)8-12/h3-9H,1-2H3,(H,19,21)
InChIKeyYKUNKANQQKJPQQ-UHFFFAOYSA-N
MW283.31 g/mol
LogP3.87
Rot. Bonds1

About N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide

N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide (PubChem CID 22510428) has the molecular formula C16H14FN3O and a molecular weight of 283.31 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide
PubChem CID22510428
Molecular FormulaC16H14FN3O
Molecular Weight283.31 g/mol
Exact Mass283.11
IUPAC NameN-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide
SMILESCc1ccc(NC(=O)n2ncc3c(C)cccc32)cc1F
InChIInChI=1S/C16H14FN3O/c1-10-4-3-5-15-13(10)9-18-20(15)16(21)19-12-7-6-11(2)14(17)8-12/h3-9H,1-2H3,(H,19,21)
InChIKeyYKUNKANQQKJPQQ-UHFFFAOYSA-N
XLogP3.87
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-fluoro-4-methylphenyl)-4-methylindazole-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

2-fluoro-N-(3-fluoro-4-methylphenyl)-3-methylbenzamide
CID 80718596
N-(4-fluorophenyl)indazole-1-carboxamide
CID 53033778
N-(3-fluoro-4-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 9210715
3-(carbamoylamino)-N-(3-fluoro-4-methylphenyl)benzamide
CID 9210618
(3aS,7aR)-N-(3-fluoro-4-methylphenyl)-1,3,3a,4,7,7a-hexahydroisoindole-2-carboxamide
CID 72872228
N-(3-fluoro-4-methylphenyl)-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 16579165
N-(3-fluoro-4-methylphenyl)-4-[(1S)-1-phenylethyl]piperazine-1-carboxamide
CID 92757467
2-(ethylamino)-N-(3-fluoro-4-methylphenyl)acetamide
CID 60641239
2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(3-fluoro-4-methylphenyl)acetamide
CID 9435782
2-(4-bromopyrazol-1-yl)-N-(3-fluoro-4-methylphenyl)acetamide
CID 47263262
1-(3-fluoro-4-methylphenyl)-3-(3-methylsulfanylphenyl)urea
CID 112839665
N-(3-fluoro-4-methylphenyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carboxamide
CID 17087632

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide (CID 22510428) is N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide is Cc1ccc(NC(=O)n2ncc3c(C)cccc32)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide?
The InChIKey is YKUNKANQQKJPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O/c1-10-4-3-5-15-13(10)9-18-20(15)16(21)19-12-7-6-11(2)14(17)8-12/h3-9H,1-2H3,(H,19,21).
What are the key properties of N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide?
N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide has a molecular weight of 283.31 g/mol, XLogP of 3.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-4-methylindazole-1-carboxamide is sourced from PubChem (CID 22510428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).