3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one

C14H14N4O — CID 45258655

IUPAC3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one
SMILESCCc1cc(C)nn1-c1nc2ccccc2[nH]c1=O
InChIInChI=1S/C14H14N4O/c1-3-10-8-9(2)17-18(10)13-14(19)16-12-7-5-4-6-11(12)15-13/h4-8H,3H2,1-2H3,(H,16,19)
InChIKeyWROMZALCGAFQAW-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.98
Rot. Bonds2

About 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one

3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one (PubChem CID 45258655) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one.

Molecular Properties

Compound Name3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one
PubChem CID45258655
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one
SMILESCCc1cc(C)nn1-c1nc2ccccc2[nH]c1=O
InChIInChI=1S/C14H14N4O/c1-3-10-8-9(2)17-18(10)13-14(19)16-12-7-5-4-6-11(12)15-13/h4-8H,3H2,1-2H3,(H,16,19)
InChIKeyWROMZALCGAFQAW-UHFFFAOYSA-N
XLogP1.98
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2R)-2-ethylpiperidin-1-yl]-1H-quinoxalin-2-one
CID 95563134
2-(3,5-diethylpyrazol-1-yl)-3-methylquinoxaline
CID 82698966
3-(propylamino)-1H-quinoxalin-2-one
CID 167442718
N,N-diethyl-3-oxo-4H-quinoxaline-2-carboxamide
CID 10444556
N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-4-methylbenzenesulfonamide
CID 2426865
N-[2-(1H-benzimidazol-2-yl)ethyl]-2,5-dimethylpyrazole-3-carboxamide
CID 52693788
[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl] 2,2-diphenylacetate
CID 16585211
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-oxo-4H-quinoxaline-2-carboxamide
CID 56702804
N-(1H-benzimidazol-2-ylmethyl)-2-(3,5-dimethylpyrazol-1-yl)benzamide
CID 21008755
N-[2-(1H-benzimidazol-2-yl)-5-methylpyrazol-3-yl]-3-bromobenzamide
CID 3343842
bis(2-ethyl-1H-benzimidazole);sulfane
CID 68768079
3-(3,6-dimethyl-[1,2,4]triazolo[3,4-f][1,2,4]triazin-8-yl)-1H-quinoxalin-2-one
CID 135818382

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one?
The IUPAC name of 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one (CID 45258655) is 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one.
What is the SMILES notation for 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one?
The canonical SMILES for 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one is CCc1cc(C)nn1-c1nc2ccccc2[nH]c1=O.
What is the InChIKey of 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one?
The InChIKey is WROMZALCGAFQAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-3-10-8-9(2)17-18(10)13-14(19)16-12-7-5-4-6-11(12)15-13/h4-8H,3H2,1-2H3,(H,16,19).
What are the key properties of 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one?
3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one has a molecular weight of 254.29 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-3-methylpyrazol-1-yl)-1H-quinoxalin-2-one is sourced from PubChem (CID 45258655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).