2-(3,6-dimethylindazol-2-yl)acetamide

C11H13N3O — CID 176997387

IUPAC2-(3,6-dimethylindazol-2-yl)acetamide
SMILESCc1ccc2c(C)n(CC(N)=O)nc2c1
InChIInChI=1S/C11H13N3O/c1-7-3-4-9-8(2)14(6-11(12)15)13-10(9)5-7/h3-5H,6H2,1-2H3,(H2,12,15)
InChIKeyQDSAXZITPZKHRQ-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.14
Rot. Bonds2

About 2-(3,6-dimethylindazol-2-yl)acetamide

2-(3,6-dimethylindazol-2-yl)acetamide (PubChem CID 176997387) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-(3,6-dimethylindazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,6-dimethylindazol-2-yl)acetamide
PubChem CID176997387
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name2-(3,6-dimethylindazol-2-yl)acetamide
SMILESCc1ccc2c(C)n(CC(N)=O)nc2c1
InChIInChI=1S/C11H13N3O/c1-7-3-4-9-8(2)14(6-11(12)15)13-10(9)5-7/h3-5H,6H2,1-2H3,(H2,12,15)
InChIKeyQDSAXZITPZKHRQ-UHFFFAOYSA-N
XLogP1.14
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluoro-3,6-dimethylindazol-2-yl)acetamide
CID 176997329
2-(cyclopropylmethyl)-3,6-dimethylindazole;ethane
CID 176566562
2-(4,7-dimethylquinazolin-2-yl)sulfanylacetamide
CID 25249525
2-[4-methyl-3-(4-methylphenyl)-5-oxo-1,2,4-triazol-1-yl]acetamide
CID 143582191
2-[4-(aminomethyl)-3,5-dimethylpyrazol-1-yl]acetamide
CID 43647536
3-(3-bromo-6-methylindazol-2-yl)propan-1-amine
CID 84729921
3-bromo-2,6-dimethylindazole
CID 84725646
3-iodo-2,6-dimethylindazole
CID 90223545
(2,6-dimethylindazol-3-yl)methanamine
CID 84717621
ethyl 2-(5-methylbenzotriazol-1-yl)acetate
CID 71658803
2-(3-iodo-5-methylindazol-1-yl)acetic acid
CID 71223562
2-[1-(2-amino-2-oxoethyl)-5-methylbenzimidazol-2-yl]sulfanylacetic acid
CID 43661232

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dimethylindazol-2-yl)acetamide?
The IUPAC name of 2-(3,6-dimethylindazol-2-yl)acetamide (CID 176997387) is 2-(3,6-dimethylindazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,6-dimethylindazol-2-yl)acetamide?
The canonical SMILES for 2-(3,6-dimethylindazol-2-yl)acetamide is Cc1ccc2c(C)n(CC(N)=O)nc2c1.
What is the InChIKey of 2-(3,6-dimethylindazol-2-yl)acetamide?
The InChIKey is QDSAXZITPZKHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7-3-4-9-8(2)14(6-11(12)15)13-10(9)5-7/h3-5H,6H2,1-2H3,(H2,12,15).
What are the key properties of 2-(3,6-dimethylindazol-2-yl)acetamide?
2-(3,6-dimethylindazol-2-yl)acetamide has a molecular weight of 203.24 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,6-dimethylindazol-2-yl)acetamide is sourced from PubChem (CID 176997387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).