3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide

C22H18FN3O2 — CID 22260682

IUPAC3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
SMILESCOc1cccc(CNC(=O)c2ccc3c(-c4cccc(F)c4)n[nH]c3c2)c1
InChIInChI=1S/C22H18FN3O2/c1-28-18-7-2-4-14(10-18)13-24-22(27)16-8-9-19-20(12-16)25-26-21(19)15-5-3-6-17(23)11-15/h2-12H,13H2,1H3,(H,24,27)(H,25,26)
InChIKeyOCQGBIIQCPKCDR-UHFFFAOYSA-N
MW375.40 g/mol
LogP4.31
Rot. Bonds5

About 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide

3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide (PubChem CID 22260682) has the molecular formula C22H18FN3O2 and a molecular weight of 375.40 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide.

Molecular Properties

Compound Name3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
PubChem CID22260682
Molecular FormulaC22H18FN3O2
Molecular Weight375.40 g/mol
Exact Mass375.14
IUPAC Name3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
SMILESCOc1cccc(CNC(=O)c2ccc3c(-c4cccc(F)c4)n[nH]c3c2)c1
InChIInChI=1S/C22H18FN3O2/c1-28-18-7-2-4-14(10-18)13-24-22(27)16-8-9-19-20(12-16)25-26-21(19)15-5-3-6-17(23)11-15/h2-12H,13H2,1H3,(H,24,27)(H,25,26)
InChIKeyOCQGBIIQCPKCDR-UHFFFAOYSA-N
XLogP4.31
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.40
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)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-[[3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-3-methoxybenzamide
CID 22260912
2-[3-(3-fluorophenyl)-1H-indazol-5-yl]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22260918
3-fluoro-N-[(3-methoxyphenyl)methyl]-4-methylbenzamide
CID 9088186
3,4-difluoro-N-[(3-methoxyphenyl)methyl]benzamide
CID 30491738
4-[[2-(3-fluorophenyl)pyrimidin-4-yl]amino]-N-[(3-methoxyphenyl)methyl]benzamide
CID 53078315
N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]pyridine-3-carboxamide
CID 22260966
1-[(3-fluorophenyl)methyl]-3-[(3-methoxyphenyl)methyl]urea
CID 52581023
3-(3-fluorophenyl)-N-(5-hydroxy-3-methylpentyl)-1H-indazole-5-carboxamide
CID 175236372
4-[(3-methoxyphenyl)methylcarbamoyl]benzoic acid
CID 61028664
N-[(3-methoxyphenyl)methyl]-5-methyl-1H-indazole-3-carboxamide
CID 78858952
methyl 3-(3-fluorophenyl)-1H-indazole-5-carboxylate
CID 22260721
N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19509626

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide?
The IUPAC name of 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide (CID 22260682) is 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide.
What is the SMILES notation for 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide?
The canonical SMILES for 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide is COc1cccc(CNC(=O)c2ccc3c(-c4cccc(F)c4)n[nH]c3c2)c1.
What is the InChIKey of 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide?
The InChIKey is OCQGBIIQCPKCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O2/c1-28-18-7-2-4-14(10-18)13-24-22(27)16-8-9-19-20(12-16)25-26-21(19)15-5-3-6-17(23)11-15/h2-12H,13H2,1H3,(H,24,27)(H,25,26).
What are the key properties of 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide?
3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide has a molecular weight of 375.40 g/mol, XLogP of 4.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide is sourced from PubChem (CID 22260682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).