3-fluoro-6-methyl-1,2-dihydropyrazine

C5H7FN2 — CID 163735443

IUPAC3-fluoro-6-methyl-1,2-dihydropyrazine
SMILESCC1=CN=C(F)CN1
InChIInChI=1S/C5H7FN2/c1-4-2-8-5(6)3-7-4/h2,7H,3H2,1H3
InChIKeyLDEFHYYLMRJDCX-UHFFFAOYSA-N
MW114.12 g/mol
LogP0.82
Rot. Bonds

About 3-fluoro-6-methyl-1,2-dihydropyrazine

3-fluoro-6-methyl-1,2-dihydropyrazine (PubChem CID 163735443) has the molecular formula C5H7FN2 and a molecular weight of 114.12 g/mol. Its IUPAC name is 3-fluoro-6-methyl-1,2-dihydropyrazine.

Molecular Properties

Compound Name3-fluoro-6-methyl-1,2-dihydropyrazine
PubChem CID163735443
Molecular FormulaC5H7FN2
Molecular Weight114.12 g/mol
Exact Mass114.06
IUPAC Name3-fluoro-6-methyl-1,2-dihydropyrazine
SMILESCC1=CN=C(F)CN1
InChIInChI=1S/C5H7FN2/c1-4-2-8-5(6)3-7-4/h2,7H,3H2,1H3
InChIKeyLDEFHYYLMRJDCX-UHFFFAOYSA-N
XLogP0.82
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.12
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Methyl-1,2-dihydropyrazine
CID 66607554
6-Methyl-1,2-dihydropyrazine
CID 68099554
3,6-Dimethyl-1,2-dihydropyrazine
CID 88986983
(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
CID 89138569
(6-Methyl-1,2-dihydropyrazin-3-yl)methanamine
CID 89185799
Ethane;5-methyl-1,2-dihydropyrazine
CID 141816510
CID 142023832
CID 142023832
3-Iodo-6-methyl-1,2-dihydropyrazine
CID 170444074
3-methyl-1H-pyrazine
CID 176521364
2-methyl-1H-pyrazine
CID 176532659
3,6-dimethyl-1H-pyrazine
CID 177723886
(E)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
CID 144605365

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-methyl-1,2-dihydropyrazine?
The IUPAC name of 3-fluoro-6-methyl-1,2-dihydropyrazine (CID 163735443) is 3-fluoro-6-methyl-1,2-dihydropyrazine.
What is the SMILES notation for 3-fluoro-6-methyl-1,2-dihydropyrazine?
The canonical SMILES for 3-fluoro-6-methyl-1,2-dihydropyrazine is CC1=CN=C(F)CN1.
What is the InChIKey of 3-fluoro-6-methyl-1,2-dihydropyrazine?
The InChIKey is LDEFHYYLMRJDCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2/c1-4-2-8-5(6)3-7-4/h2,7H,3H2,1H3.
What are the key properties of 3-fluoro-6-methyl-1,2-dihydropyrazine?
3-fluoro-6-methyl-1,2-dihydropyrazine has a molecular weight of 114.12 g/mol, XLogP of 0.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-methyl-1,2-dihydropyrazine is sourced from PubChem (CID 163735443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).