1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole

C11H11N5 — CID 103119734

IUPAC1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole
SMILESCc1nc(-c2nn(C)c3ccccc23)n[nH]1
InChIInChI=1S/C11H11N5/c1-7-12-11(14-13-7)10-8-5-3-4-6-9(8)16(2)15-10/h3-6H,1-2H3,(H,12,13,14)
InChIKeyGKYZTGILMHYUCN-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.67
Rot. Bonds1

About 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole

1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole (PubChem CID 103119734) has the molecular formula C11H11N5 and a molecular weight of 213.24 g/mol. Its IUPAC name is 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole.

Molecular Properties

Compound Name1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole
PubChem CID103119734
Molecular FormulaC11H11N5
Molecular Weight213.24 g/mol
Exact Mass213.10
IUPAC Name1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole
SMILESCc1nc(-c2nn(C)c3ccccc23)n[nH]1
InChIInChI=1S/C11H11N5/c1-7-12-11(14-13-7)10-8-5-3-4-6-9(8)16(2)15-10/h3-6H,1-2H3,(H,12,13,14)
InChIKeyGKYZTGILMHYUCN-UHFFFAOYSA-N
XLogP1.67
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indole
CID 147456489
1,4-dimethyl-3-(1-methylindazol-3-yl)pyrazol-5-amine
CID 103118715
4-(1-methylindazol-3-yl)-2-phenyl-1,3-oxazole
CID 139216519
3-iodo-5-(1-methylindazol-3-yl)-1,2,4-thiadiazole
CID 103130052
2-methyl-5-(1-methylindazol-3-yl)-1H-1,2,4-triazole-3-thione
CID 103119827
(1-methylindazol-3-yl)-[2-(5-methyl-1H-1,2,4-triazol-3-yl)pyrrolidin-1-yl]methanone
CID 87052010
4-amino-6-(1-methylindazol-3-yl)-1H-1,3,5-triazin-2-one
CID 136980728
3-(5-methyl-1H-1,2,4-triazol-3-yl)-1-(3,3,3-trifluoropropyl)pyrazolo[5,4-b]pyridine
CID 146433891
1-methyl-3-thiophen-2-ylindazole
CID 57338749
2-chloro-4-(1-methylindazol-3-yl)pyrimidine-5-carbonitrile;molecular fluorine
CID 161149045
2-(1-methylindazol-3-yl)-3H-benzimidazol-5-ol
CID 136785862
8-(1-methylindazol-3-yl)-7H-purin-6-amine
CID 136785887

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole?
The IUPAC name of 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole (CID 103119734) is 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole.
What is the SMILES notation for 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole?
The canonical SMILES for 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole is Cc1nc(-c2nn(C)c3ccccc23)n[nH]1.
What is the InChIKey of 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole?
The InChIKey is GKYZTGILMHYUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5/c1-7-12-11(14-13-7)10-8-5-3-4-6-9(8)16(2)15-10/h3-6H,1-2H3,(H,12,13,14).
What are the key properties of 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole?
1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole has a molecular weight of 213.24 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(5-methyl-1H-1,2,4-triazol-3-yl)indazole is sourced from PubChem (CID 103119734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).