N-(1H-indazol-6-yl)-3,5-dimethylbenzamide

C16H15N3O — CID 36560760

IUPACN-(1H-indazol-6-yl)-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C16H15N3O/c1-10-5-11(2)7-13(6-10)16(20)18-14-4-3-12-9-17-19-15(12)8-14/h3-9H,1-2H3,(H,17,19)(H,18,20)
InChIKeyNMAIVOPZQRVXKB-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.43
Rot. Bonds2

About N-(1H-indazol-6-yl)-3,5-dimethylbenzamide

N-(1H-indazol-6-yl)-3,5-dimethylbenzamide (PubChem CID 36560760) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)-3,5-dimethylbenzamide
PubChem CID36560760
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC NameN-(1H-indazol-6-yl)-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccc3cn[nH]c3c2)c1
InChIInChI=1S/C16H15N3O/c1-10-5-11(2)7-13(6-10)16(20)18-14-4-3-12-9-17-19-15(12)8-14/h3-9H,1-2H3,(H,17,19)(H,18,20)
InChIKeyNMAIVOPZQRVXKB-UHFFFAOYSA-N
XLogP3.43
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-(1H-indazol-6-ylcarbamoyl)benzoate
CID 121088219
4-bromo-N-(1H-indazol-6-yl)-3-methylbenzamide
CID 115769574
1-(1H-indazol-6-yl)-3-(4-methylphenyl)urea
CID 4256141
N-(1H-indazol-6-yl)-3-methyl-4-nitrobenzamide
CID 36560800
2-fluoro-N-(1H-indazol-6-yl)-5-methylbenzamide
CID 62512997
N-(1H-indazol-5-yl)-4-methylbenzamide
CID 17163732
N-(1H-indazol-6-yl)-6-methylpyridazine-3-carboxamide
CID 110705354
6-bromo-N-(1H-indazol-6-yl)pyridine-3-carboxamide
CID 66464887
N-(1H-indazol-6-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 110684914
3-amino-5-(dimethylsulfamoyl)-N-(1H-indazol-6-yl)benzamide
CID 118760029
N-(1H-indazol-6-yl)-2H-benzotriazole-5-carboxamide
CID 36561248
N-(1H-indazol-6-yl)-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 110692000

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)-3,5-dimethylbenzamide?
The IUPAC name of N-(1H-indazol-6-yl)-3,5-dimethylbenzamide (CID 36560760) is N-(1H-indazol-6-yl)-3,5-dimethylbenzamide.
What is the SMILES notation for N-(1H-indazol-6-yl)-3,5-dimethylbenzamide?
The canonical SMILES for N-(1H-indazol-6-yl)-3,5-dimethylbenzamide is Cc1cc(C)cc(C(=O)Nc2ccc3cn[nH]c3c2)c1.
What is the InChIKey of N-(1H-indazol-6-yl)-3,5-dimethylbenzamide?
The InChIKey is NMAIVOPZQRVXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-10-5-11(2)7-13(6-10)16(20)18-14-4-3-12-9-17-19-15(12)8-14/h3-9H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-(1H-indazol-6-yl)-3,5-dimethylbenzamide?
N-(1H-indazol-6-yl)-3,5-dimethylbenzamide has a molecular weight of 265.32 g/mol, XLogP of 3.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)-3,5-dimethylbenzamide is sourced from PubChem (CID 36560760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).