5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid

C26H24N6O4 — CID 174725773

IUPAC5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid
SMILESO=C(NC1CCCCC1)c1cncc(-c2ccc3c(c2)c(C(=O)O)nn3C(=O)Nc2cccnc2)c1
InChIInChI=1S/C26H24N6O4/c33-24(29-19-5-2-1-3-6-19)18-11-17(13-28-14-18)16-8-9-22-21(12-16)23(25(34)35)31-32(22)26(36)30-20-7-4-10-27-15-20/h4,7-15,19H,1-3,5-6H2,(H,29,33)(H,30,36)(H,34,35)
InChIKeyDPQTUALKHWAXPG-UHFFFAOYSA-N
MW484.52 g/mol
LogP4.33
Rot. Bonds5

About 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid

5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid (PubChem CID 174725773) has the molecular formula C26H24N6O4 and a molecular weight of 484.52 g/mol. Its IUPAC name is 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid.

Molecular Properties

Compound Name5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid
PubChem CID174725773
Molecular FormulaC26H24N6O4
Molecular Weight484.52 g/mol
Exact Mass484.19
IUPAC Name5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid
SMILESO=C(NC1CCCCC1)c1cncc(-c2ccc3c(c2)c(C(=O)O)nn3C(=O)Nc2cccnc2)c1
InChIInChI=1S/C26H24N6O4/c33-24(29-19-5-2-1-3-6-19)18-11-17(13-28-14-18)16-8-9-22-21(12-16)23(25(34)35)31-32(22)26(36)30-20-7-4-10-27-15-20/h4,7-15,19H,1-3,5-6H2,(H,29,33)(H,30,36)(H,34,35)
InChIKeyDPQTUALKHWAXPG-UHFFFAOYSA-N
XLogP4.33
TPSA139.10 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.52
LogP ≤ 54.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid 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

1-[[5-(3-fluorophenyl)-3-pyridinyl]carbamoyl]-5-pyridin-3-ylindazole-3-carboxylic acid
CID 174725752
1-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]carbamoyl]-5-pyridin-3-ylindazole-3-carboxylic acid
CID 174725876
5-pyridin-3-yl-1-(2-pyrrolidin-1-ylethylcarbamoyl)indazole-3-carboxylic acid
CID 174835132
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1-[(6-pyrrolidin-1-yl-3-pyridinyl)carbamoyl]indazole-3-carboxylic acid
CID 175285285
5-anilino-N-cyclohexylpyridine-3-carboxamide
CID 109226711
1-(oxan-2-yl)-5-pyridin-3-ylindazole-3-carboxylic acid
CID 86679701
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1-[[2-(trifluoromethyl)-4-pyridinyl]carbamoyl]indazole-3-carboxylic acid
CID 174835308
N-cyclohexyl-5-(4-methylphenyl)pyridine-3-carboxamide
CID 46032904
5-N-cyclohexyl-3-N-phenylpyridine-3,5-dicarboxamide
CID 109103063
N-[1-[5-[5-[1-(cyclohexylamino)ethenyl]-3-pyridinyl]-1H-indazol-3-yl]ethenyl]pyridin-3-amine
CID 134460542
1-[2-(dimethylamino)ethylcarbamoyl]-5-pyridin-3-ylindazole-3-carboxylic acid
CID 174835202
N-cyclopropyl-5-(4-phenylphenyl)pyridine-3-carboxamide
CID 42845850

Frequently Asked Questions

What is the IUPAC name of 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid?
The IUPAC name of 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid (CID 174725773) is 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid.
What is the SMILES notation for 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid?
The canonical SMILES for 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid is O=C(NC1CCCCC1)c1cncc(-c2ccc3c(c2)c(C(=O)O)nn3C(=O)Nc2cccnc2)c1.
What is the InChIKey of 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid?
The InChIKey is DPQTUALKHWAXPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6O4/c33-24(29-19-5-2-1-3-6-19)18-11-17(13-28-14-18)16-8-9-22-21(12-16)23(25(34)35)31-32(22)26(36)30-20-7-4-10-27-15-20/h4,7-15,19H,1-3,5-6H2,(H,29,33)(H,30,36)(H,34,35).
What are the key properties of 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid?
5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid has a molecular weight of 484.52 g/mol, XLogP of 4.33, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(cyclohexylcarbamoyl)-3-pyridinyl]-1-(pyridin-3-ylcarbamoyl)indazole-3-carboxylic acid is sourced from PubChem (CID 174725773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).