3-(5-methyl-1H-indazol-3-yl)benzamide

C15H13N3O — CID 155410664

IUPAC3-(5-methyl-1H-indazol-3-yl)benzamide
SMILESCc1ccc2[nH]nc(-c3cccc(C(N)=O)c3)c2c1
InChIInChI=1S/C15H13N3O/c1-9-5-6-13-12(7-9)14(18-17-13)10-3-2-4-11(8-10)15(16)19/h2-8H,1H3,(H2,16,19)(H,17,18)
InChIKeyMZGWRWOSTXJYFY-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.64
Rot. Bonds2

About 3-(5-methyl-1H-indazol-3-yl)benzamide

3-(5-methyl-1H-indazol-3-yl)benzamide (PubChem CID 155410664) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-(5-methyl-1H-indazol-3-yl)benzamide.

Molecular Properties

Compound Name3-(5-methyl-1H-indazol-3-yl)benzamide
PubChem CID155410664
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name3-(5-methyl-1H-indazol-3-yl)benzamide
SMILESCc1ccc2[nH]nc(-c3cccc(C(N)=O)c3)c2c1
InChIInChI=1S/C15H13N3O/c1-9-5-6-13-12(7-9)14(18-17-13)10-3-2-4-11(8-10)15(16)19/h2-8H,1H3,(H2,16,19)(H,17,18)
InChIKeyMZGWRWOSTXJYFY-UHFFFAOYSA-N
XLogP2.64
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

anthra(1,9-cd)pyrazol-6(2H)-one
CID 8515
1H-Indazole-3-carboxamide
CID 20978176
N-Phenyl-1H-indazole-3-carboxamide
CID 9341021
Cumyl-inaca
CID 117645167
N'-benzoyl-1H-indazole-3-carbohydrazide
CID 4789701
N-(3-methylphenyl)-1H-indazole-3-carboxamide
CID 1505876
n-Phenyl-1h-indazole-5-carboxamide
CID 22933429
N-(3,4-difluorophenyl)-1H-indazole-5-carboxamide
CID 77844665
N-methyl-3-[(3-methylphenyl)methyl]-2H-indazole-5-carboxamide
CID 118959947
2,2,2-trifluoro-1-[4-(6-fluoro-1H-indazol-3-yl)phenyl]ethanone
CID 155424830
1-(1H-indazol-3-yl)ethan-1-one
CID 15684169
Indazole-3-carbaldehyde
CID 11367068

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1H-indazol-3-yl)benzamide?
The IUPAC name of 3-(5-methyl-1H-indazol-3-yl)benzamide (CID 155410664) is 3-(5-methyl-1H-indazol-3-yl)benzamide.
What is the SMILES notation for 3-(5-methyl-1H-indazol-3-yl)benzamide?
The canonical SMILES for 3-(5-methyl-1H-indazol-3-yl)benzamide is Cc1ccc2[nH]nc(-c3cccc(C(N)=O)c3)c2c1.
What is the InChIKey of 3-(5-methyl-1H-indazol-3-yl)benzamide?
The InChIKey is MZGWRWOSTXJYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-9-5-6-13-12(7-9)14(18-17-13)10-3-2-4-11(8-10)15(16)19/h2-8H,1H3,(H2,16,19)(H,17,18).
What are the key properties of 3-(5-methyl-1H-indazol-3-yl)benzamide?
3-(5-methyl-1H-indazol-3-yl)benzamide has a molecular weight of 251.29 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1H-indazol-3-yl)benzamide is sourced from PubChem (CID 155410664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).