N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide

C17H17N3O — CID 60715255

IUPACN-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide
SMILESCC(C)c1cccc(NC(=O)c2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C17H17N3O/c1-11(2)12-4-3-5-15(8-12)19-17(21)13-6-7-14-10-18-20-16(14)9-13/h3-11H,1-2H3,(H,18,20)(H,19,21)
InChIKeyOODJPQGENYPATA-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.94
Rot. Bonds3

About N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide

N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide (PubChem CID 60715255) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide
PubChem CID60715255
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC NameN-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide
SMILESCC(C)c1cccc(NC(=O)c2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C17H17N3O/c1-11(2)12-4-3-5-15(8-12)19-17(21)13-6-7-14-10-18-20-16(14)9-13/h3-11H,1-2H3,(H,18,20)(H,19,21)
InChIKeyOODJPQGENYPATA-UHFFFAOYSA-N
XLogP3.94
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-ethylphenyl)-1H-indazole-6-carboxamide
CID 60715268
N-(1H-indazol-6-yl)-2-propan-2-yl-3H-benzimidazole-5-carboxamide
CID 110765672
methyl 4-(1H-indazol-6-ylcarbamoyl)benzoate
CID 121088219
N-(3,5-dichlorophenyl)-1H-indazole-6-carboxamide
CID 60714993
N-(3-methylbutan-2-yl)-1H-indazole-6-carboxamide
CID 55023710
N-[1-(3-fluorophenyl)ethyl]-1H-indazole-6-carboxamide
CID 60715179
N-naphthalen-2-yl-1H-indazole-5-carboxamide
CID 69422881
N-(6-methyl-2-pyridinyl)-1H-indazole-6-carboxamide
CID 55023758
4-bromo-N-(1H-indazol-6-yl)-3-methylbenzamide
CID 115769574
(2R)-2-(1H-indazole-6-carbonylamino)propanoic acid
CID 51888645
N-(1H-indazol-6-yl)-3,5-dimethylbenzamide
CID 36560760
N-(2-acetylphenyl)-1H-indazole-6-carboxamide
CID 110485418

Frequently Asked Questions

What is the IUPAC name of N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide?
The IUPAC name of N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide (CID 60715255) is N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide?
The canonical SMILES for N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide is CC(C)c1cccc(NC(=O)c2ccc3cn[nH]c3c2)c1.
What is the InChIKey of N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide?
The InChIKey is OODJPQGENYPATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-11(2)12-4-3-5-15(8-12)19-17(21)13-6-7-14-10-18-20-16(14)9-13/h3-11H,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide?
N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 3.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-propan-2-ylphenyl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 60715255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).