2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine

C13H14F2N4 — CID 103587838

IUPAC2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine
SMILESCCNc1cncc(Nc2cc(F)c(C)cc2F)n1
InChIInChI=1S/C13H14F2N4/c1-3-17-12-6-16-7-13(19-12)18-11-5-9(14)8(2)4-10(11)15/h4-7H,3H2,1-2H3,(H2,17,18,19)
InChIKeySNEURFPUGDUHGW-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.24
Rot. Bonds4

About 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine

2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine (PubChem CID 103587838) has the molecular formula C13H14F2N4 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine.

Molecular Properties

Compound Name2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine
PubChem CID103587838
Molecular FormulaC13H14F2N4
Molecular Weight264.28 g/mol
Exact Mass264.12
IUPAC Name2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine
SMILESCCNc1cncc(Nc2cc(F)c(C)cc2F)n1
InChIInChI=1S/C13H14F2N4/c1-3-17-12-6-16-7-13(19-12)18-11-5-9(14)8(2)4-10(11)15/h4-7H,3H2,1-2H3,(H2,17,18,19)
InChIKeySNEURFPUGDUHGW-UHFFFAOYSA-N
XLogP3.24
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine 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

6-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyridine-2,6-diamine
CID 103587849
2-N-(5-bromo-2,4-difluorophenyl)-6-N-ethylpyrazine-2,6-diamine
CID 102855613
N-(2,5-difluoro-4-methylphenyl)-6-hydrazinylpyrazin-2-amine
CID 103587925
2-N-(4-bromo-2-fluorophenyl)-6-N-ethylpyrazine-2,6-diamine
CID 80759491
6-N-ethyl-2-N-(2,3,5-trifluorophenyl)pyrazine-2,6-diamine
CID 80825638
2-N-(2,5-dichloro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine
CID 104728613
6-N-ethyl-2-N-(3-fluoro-5-methylphenyl)pyrazine-2,6-diamine
CID 80851533
4-N-(2,5-difluoro-4-methylphenyl)-2-N-ethyl-5-methylpyrimidine-2,4-diamine
CID 103587790
2-N-(2,6-difluorophenyl)-6-N-ethylpyrazine-2,6-diamine
CID 80755020
2-N-(4-bromo-3-fluorophenyl)-6-N-ethylpyrazine-2,6-diamine
CID 80843376
5-chloro-4-N-(2,5-difluoro-4-methylphenyl)-2-N-ethylpyrimidine-2,4-diamine
CID 103587868
6-N-ethyl-2-N-(4-methylphenyl)pyrazine-2,6-diamine
CID 80761835

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine?
The IUPAC name of 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine (CID 103587838) is 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine.
What is the SMILES notation for 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine?
The canonical SMILES for 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine is CCNc1cncc(Nc2cc(F)c(C)cc2F)n1.
What is the InChIKey of 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine?
The InChIKey is SNEURFPUGDUHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14F2N4/c1-3-17-12-6-16-7-13(19-12)18-11-5-9(14)8(2)4-10(11)15/h4-7H,3H2,1-2H3,(H2,17,18,19).
What are the key properties of 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine?
2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine has a molecular weight of 264.28 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,5-difluoro-4-methylphenyl)-6-N-ethylpyrazine-2,6-diamine is sourced from PubChem (CID 103587838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).