1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one

C15H19N3O — CID 133440153

IUPAC1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one
SMILESCCc1cc(Nc2nccn(CC)c2=O)ccc1C
InChIInChI=1S/C15H19N3O/c1-4-12-10-13(7-6-11(12)3)17-14-15(19)18(5-2)9-8-16-14/h6-10H,4-5H2,1-3H3,(H,16,17)
InChIKeyHHHQSYZQTCMOCF-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.88
Rot. Bonds4

About 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one

1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one (PubChem CID 133440153) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one
PubChem CID133440153
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one
SMILESCCc1cc(Nc2nccn(CC)c2=O)ccc1C
InChIInChI=1S/C15H19N3O/c1-4-12-10-13(7-6-11(12)3)17-14-15(19)18(5-2)9-8-16-14/h6-10H,4-5H2,1-3H3,(H,16,17)
InChIKeyHHHQSYZQTCMOCF-UHFFFAOYSA-N
XLogP2.88
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-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-(3,4-dimethylanilino)-1-ethylpyrazin-2-one
CID 133446969
3-(4-aminoanilino)-1-ethylpyrazin-2-one
CID 62939816
3-(4-tert-butylanilino)-1-ethylpyrazin-2-one
CID 133446905
4-[(4-ethyl-3-oxopyrazin-2-yl)amino]-2-fluorobenzoic acid
CID 107793302
1-ethyl-3-[(2-methylphenyl)methylamino]pyrazin-2-one
CID 62938284
methyl N-[[4-[(4-ethyl-3-oxopyrazin-2-yl)amino]phenyl]methyl]carbamate
CID 167875404
1-ethyl-3-[(3-ethyl-1-methylpyrazol-4-yl)amino]pyrazin-2-one
CID 113349594
1-ethyl-3-(3-hydroxypropylamino)pyrazin-2-one
CID 62939492
1-ethyl-3-methylpyrazin-2-one
CID 90291055
3-[3-(aminomethyl)-4-ethoxyanilino]-1-methylpyrazin-2-one
CID 63759633
3-[(2,4-difluorophenyl)methylamino]-1-ethylpyrazin-2-one
CID 62927930
1-ethyl-3-(pyridin-4-ylmethylamino)pyrazin-2-one
CID 62940009

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one?
The IUPAC name of 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one (CID 133440153) is 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one is CCc1cc(Nc2nccn(CC)c2=O)ccc1C.
What is the InChIKey of 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one?
The InChIKey is HHHQSYZQTCMOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-12-10-13(7-6-11(12)3)17-14-15(19)18(5-2)9-8-16-14/h6-10H,4-5H2,1-3H3,(H,16,17).
What are the key properties of 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one?
1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one has a molecular weight of 257.34 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-ethyl-4-methylanilino)pyrazin-2-one is sourced from PubChem (CID 133440153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).