N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide

C11H10N6O2 — CID 83086847

IUPACN-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide
SMILESCOc1n[nH]c(NC(=O)c2n[nH]c3ccccc23)n1
InChIInChI=1S/C11H10N6O2/c1-19-11-13-10(16-17-11)12-9(18)8-6-4-2-3-5-7(6)14-15-8/h2-5H,1H3,(H,14,15)(H2,12,13,16,17,18)
InChIKeyUXBHIJGOQUIAOK-UHFFFAOYSA-N
MW258.24 g/mol
LogP0.94
Rot. Bonds3

About N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide

N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide (PubChem CID 83086847) has the molecular formula C11H10N6O2 and a molecular weight of 258.24 g/mol. Its IUPAC name is N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide
PubChem CID83086847
Molecular FormulaC11H10N6O2
Molecular Weight258.24 g/mol
Exact Mass258.09
IUPAC NameN-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide
SMILESCOc1n[nH]c(NC(=O)c2n[nH]c3ccccc23)n1
InChIInChI=1S/C11H10N6O2/c1-19-11-13-10(16-17-11)12-9(18)8-6-4-2-3-5-7(6)14-15-8/h2-5H,1H3,(H,14,15)(H2,12,13,16,17,18)
InChIKeyUXBHIJGOQUIAOK-UHFFFAOYSA-N
XLogP0.94
TPSA108.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-hydroxy-N-(3-methoxy-1H-1,2,4-triazol-5-yl)benzamide
CID 83086537
N-methoxy-1H-indazole-3-carboxamide
CID 60722689
3-bromo-N-(3-methoxy-1H-1,2,4-triazol-5-yl)pyridine-2-carboxamide
CID 107519851
N-(4-methoxy-6-methylpyrimidin-2-yl)-1H-indazole-3-carboxamide
CID 107602628
2-(1H-indol-3-yl)-N-(3-methoxy-1H-1,2,4-triazol-5-yl)acetamide
CID 83093520
N-(3-hydroxynaphthalen-2-yl)-1H-indazole-3-carboxamide
CID 86075446
2-(methoxymethyl)-N-(3-methoxy-1H-1,2,4-triazol-5-yl)benzamide
CID 83092939
N-(3-methoxy-1H-1,2,4-triazol-5-yl)quinoxaline-2-carboxamide
CID 83102478
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 83097894
N-(3-bromo-5-methoxyphenyl)-1H-indazole-3-carboxamide
CID 82860621
4-bromo-N-(3-methoxy-1H-1,2,4-triazol-5-yl)benzamide
CID 83093226
4-(acetamidomethyl)-N-(3-methoxy-1H-1,2,4-triazol-5-yl)benzamide
CID 83090297

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide (CID 83086847) is N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide is COc1n[nH]c(NC(=O)c2n[nH]c3ccccc23)n1.
What is the InChIKey of N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide?
The InChIKey is UXBHIJGOQUIAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6O2/c1-19-11-13-10(16-17-11)12-9(18)8-6-4-2-3-5-7(6)14-15-8/h2-5H,1H3,(H,14,15)(H2,12,13,16,17,18).
What are the key properties of N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide?
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide has a molecular weight of 258.24 g/mol, XLogP of 0.94, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-1H-1,2,4-triazol-5-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 83086847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).