3-N-(2-ethylphenyl)pyrazine-2,3-diamine

C12H14N4 — CID 102985203

IUPAC3-N-(2-ethylphenyl)pyrazine-2,3-diamine
SMILESCCc1ccccc1Nc1nccnc1N
InChIInChI=1S/C12H14N4/c1-2-9-5-3-4-6-10(9)16-12-11(13)14-7-8-15-12/h3-8H,2H2,1H3,(H2,13,14)(H,15,16)
InChIKeyOIYXYMGQXWDZSC-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.36
Rot. Bonds3

About 3-N-(2-ethylphenyl)pyrazine-2,3-diamine

3-N-(2-ethylphenyl)pyrazine-2,3-diamine (PubChem CID 102985203) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-N-(2-ethylphenyl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-(2-ethylphenyl)pyrazine-2,3-diamine
PubChem CID102985203
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name3-N-(2-ethylphenyl)pyrazine-2,3-diamine
SMILESCCc1ccccc1Nc1nccnc1N
InChIInChI=1S/C12H14N4/c1-2-9-5-3-4-6-10(9)16-12-11(13)14-7-8-15-12/h3-8H,2H2,1H3,(H2,13,14)(H,15,16)
InChIKeyOIYXYMGQXWDZSC-UHFFFAOYSA-N
XLogP2.36
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2-ethylphenyl)pyrimidine-4,5,6-triamine
CID 22544045
3-N-(2-ethyl-6-methylphenyl)pyrazine-2,3-diamine
CID 102984823
5-ethyl-4-N-(2-ethylphenyl)pyrimidine-4,6-diamine
CID 80761572
3-bromo-N-(2-ethylphenyl)pyridin-2-amine
CID 55219347
3-amino-2-(2-ethylanilino)pyridine-4-carbonitrile
CID 82817206
4-N-(2-ethylphenyl)-6-N-phenylpyrimidine-4,5,6-triamine
CID 22544115
3-N-(2-phenylphenyl)pyrazine-2,3-diamine
CID 102984843
4-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine
CID 2959709
3-N-(3-bromo-2-methylphenyl)pyrazine-2,3-diamine
CID 107638555
6-N-butyl-4-N-(2-ethylphenyl)pyrimidine-4,5,6-triamine
CID 22544033
4-N-cyclopentyl-6-N-(2-ethylphenyl)pyrimidine-4,5,6-triamine
CID 22544200
4-N-(2-ethylphenyl)quinoline-4,8-diamine
CID 83060869

Frequently Asked Questions

What is the IUPAC name of 3-N-(2-ethylphenyl)pyrazine-2,3-diamine?
The IUPAC name of 3-N-(2-ethylphenyl)pyrazine-2,3-diamine (CID 102985203) is 3-N-(2-ethylphenyl)pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-(2-ethylphenyl)pyrazine-2,3-diamine?
The canonical SMILES for 3-N-(2-ethylphenyl)pyrazine-2,3-diamine is CCc1ccccc1Nc1nccnc1N.
What is the InChIKey of 3-N-(2-ethylphenyl)pyrazine-2,3-diamine?
The InChIKey is OIYXYMGQXWDZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c1-2-9-5-3-4-6-10(9)16-12-11(13)14-7-8-15-12/h3-8H,2H2,1H3,(H2,13,14)(H,15,16).
What are the key properties of 3-N-(2-ethylphenyl)pyrazine-2,3-diamine?
3-N-(2-ethylphenyl)pyrazine-2,3-diamine has a molecular weight of 214.27 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-ethylphenyl)pyrazine-2,3-diamine is sourced from PubChem (CID 102985203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).