N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide

C14H16N8O — CID 46989829

IUPACN-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide
SMILESCCn1ncc(NC(=O)Cn2ccc(-c3nccnc3C)n2)n1
InChIInChI=1S/C14H16N8O/c1-3-22-17-8-12(20-22)18-13(23)9-21-7-4-11(19-21)14-10(2)15-5-6-16-14/h4-8H,3,9H2,1-2H3,(H,18,20,23)
InChIKeyGGWIKGMSXRTGHN-UHFFFAOYSA-N
MW312.34 g/mol
LogP0.90
Rot. Bonds5

About N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide

N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide (PubChem CID 46989829) has the molecular formula C14H16N8O and a molecular weight of 312.34 g/mol. Its IUPAC name is N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide
PubChem CID46989829
Molecular FormulaC14H16N8O
Molecular Weight312.34 g/mol
Exact Mass312.14
IUPAC NameN-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide
SMILESCCn1ncc(NC(=O)Cn2ccc(-c3nccnc3C)n2)n1
InChIInChI=1S/C14H16N8O/c1-3-22-17-8-12(20-22)18-13(23)9-21-7-4-11(19-21)14-10(2)15-5-6-16-14/h4-8H,3,9H2,1-2H3,(H,18,20,23)
InChIKeyGGWIKGMSXRTGHN-UHFFFAOYSA-N
XLogP0.90
TPSA103.41 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

methyl 1-[2-[(2-ethyltriazol-4-yl)amino]-2-oxoethyl]pyrazole-3-carboxylate
CID 46988642
2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide
CID 30869523
2-(3,5-dimethylpyrazol-1-yl)-N-(2-ethyltriazol-4-yl)acetamide
CID 46990903
2-[4-(3-methoxypyrazin-2-yl)pyrazol-1-yl]-N-(2-propyltriazol-4-yl)acetamide
CID 30920795
N-(2-propyltriazol-4-yl)-2-(triazol-1-yl)acetamide
CID 28766650
N-(2-methyltriazol-4-yl)-2-[3-[2-(trifluoromethyl)phenyl]pyrazol-1-yl]acetamide
CID 46996351
N-(2-ethyltriazol-4-yl)-2-[5-(2-methylphenyl)indazol-1-yl]acetamide
CID 46982211
2-[4-(3-acetylphenyl)-3,5-dimethylpyrazol-1-yl]-N-(2-ethyltriazol-4-yl)acetamide
CID 46983725
2-(3-aminopyrazol-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 63819555
ethyl 2-[4-[(2-phenoxyacetyl)amino]triazol-2-yl]acetate
CID 112535524
2-(4-acetamidotriazol-2-yl)-N-ethylacetamide
CID 112519987
methyl N-[2-[2-oxo-2-(pyrimidin-4-ylamino)ethyl]triazol-4-yl]carbamate
CID 112524310

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide?
The IUPAC name of N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide (CID 46989829) is N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide is CCn1ncc(NC(=O)Cn2ccc(-c3nccnc3C)n2)n1.
What is the InChIKey of N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide?
The InChIKey is GGWIKGMSXRTGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N8O/c1-3-22-17-8-12(20-22)18-13(23)9-21-7-4-11(19-21)14-10(2)15-5-6-16-14/h4-8H,3,9H2,1-2H3,(H,18,20,23).
What are the key properties of N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide?
N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide has a molecular weight of 312.34 g/mol, XLogP of 0.90, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 46989829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).