2-(4-cyclohexylphenyl)indazole-7-carboxamide

C20H21N3O — CID 129198392

IUPAC2-(4-cyclohexylphenyl)indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C4CCCCC4)cc3)nc12
InChIInChI=1S/C20H21N3O/c21-20(24)18-8-4-7-16-13-23(22-19(16)18)17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H2,21,24)
InChIKeyWFRMCISPPUGLPK-UHFFFAOYSA-N
MW319.41 g/mol
LogP4.17
Rot. Bonds3

About 2-(4-cyclohexylphenyl)indazole-7-carboxamide

2-(4-cyclohexylphenyl)indazole-7-carboxamide (PubChem CID 129198392) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-(4-cyclohexylphenyl)indazole-7-carboxamide.

Molecular Properties

Compound Name2-(4-cyclohexylphenyl)indazole-7-carboxamide
PubChem CID129198392
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC Name2-(4-cyclohexylphenyl)indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C4CCCCC4)cc3)nc12
InChIInChI=1S/C20H21N3O/c21-20(24)18-8-4-7-16-13-23(22-19(16)18)17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H2,21,24)
InChIKeyWFRMCISPPUGLPK-UHFFFAOYSA-N
XLogP4.17
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexylphenyl)indazole-7-carboxamide?
The IUPAC name of 2-(4-cyclohexylphenyl)indazole-7-carboxamide (CID 129198392) is 2-(4-cyclohexylphenyl)indazole-7-carboxamide.
What is the SMILES notation for 2-(4-cyclohexylphenyl)indazole-7-carboxamide?
The canonical SMILES for 2-(4-cyclohexylphenyl)indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C4CCCCC4)cc3)nc12.
What is the InChIKey of 2-(4-cyclohexylphenyl)indazole-7-carboxamide?
The InChIKey is WFRMCISPPUGLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c21-20(24)18-8-4-7-16-13-23(22-19(16)18)17-11-9-15(10-12-17)14-5-2-1-3-6-14/h4,7-14H,1-3,5-6H2,(H2,21,24).
What are the key properties of 2-(4-cyclohexylphenyl)indazole-7-carboxamide?
2-(4-cyclohexylphenyl)indazole-7-carboxamide has a molecular weight of 319.41 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexylphenyl)indazole-7-carboxamide is sourced from PubChem (CID 129198392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).