2-cyclobutyl-6-fluoropyrazine

C8H9FN2 — CID 123302661

IUPAC2-cyclobutyl-6-fluoropyrazine
SMILESFc1cncc(C2CCC2)n1
InChIInChI=1S/C8H9FN2/c9-8-5-10-4-7(11-8)6-2-1-3-6/h4-6H,1-3H2
InChIKeyKCKHNFGECIYUAB-UHFFFAOYSA-N
MW152.17 g/mol
LogP1.88
Rot. Bonds1

About 2-cyclobutyl-6-fluoropyrazine

2-cyclobutyl-6-fluoropyrazine (PubChem CID 123302661) has the molecular formula C8H9FN2 and a molecular weight of 152.17 g/mol. Its IUPAC name is 2-cyclobutyl-6-fluoropyrazine.

Molecular Properties

Compound Name2-cyclobutyl-6-fluoropyrazine
PubChem CID123302661
Molecular FormulaC8H9FN2
Molecular Weight152.17 g/mol
Exact Mass152.07
IUPAC Name2-cyclobutyl-6-fluoropyrazine
SMILESFc1cncc(C2CCC2)n1
InChIInChI=1S/C8H9FN2/c9-8-5-10-4-7(11-8)6-2-1-3-6/h4-6H,1-3H2
InChIKeyKCKHNFGECIYUAB-UHFFFAOYSA-N
XLogP1.88
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Isopropyl-5-methylpyrazine
CID 61700
Propylpyrazine
CID 87466
(Cyclohexylmethyl)pyrazine
CID 16204532
2-Methyl-5-propylpyrazine
CID 122383
2-Isobutyl-3,5-dimethyl-pyrazine
CID 578817
Pyrazine, (2-methylpropyl)-
CID 34591
Pentylpyrazine
CID 80551
2-Isobutyl-3,6-dimethyl-pyrazine
CID 520585
2,3-Dimethyl-5-(2-methylpropyl)pyrazine
CID 528108
2-Methyl-6-(3-methylbutyl)pyrazine
CID 572730
2,3-Dimethyl-5-propylpyrazine
CID 520566
Pyrazine, 2-methyl-6-propyl-
CID 122380

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-6-fluoropyrazine?
The IUPAC name of 2-cyclobutyl-6-fluoropyrazine (CID 123302661) is 2-cyclobutyl-6-fluoropyrazine.
What is the SMILES notation for 2-cyclobutyl-6-fluoropyrazine?
The canonical SMILES for 2-cyclobutyl-6-fluoropyrazine is Fc1cncc(C2CCC2)n1.
What is the InChIKey of 2-cyclobutyl-6-fluoropyrazine?
The InChIKey is KCKHNFGECIYUAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2/c9-8-5-10-4-7(11-8)6-2-1-3-6/h4-6H,1-3H2.
What are the key properties of 2-cyclobutyl-6-fluoropyrazine?
2-cyclobutyl-6-fluoropyrazine has a molecular weight of 152.17 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-6-fluoropyrazine is sourced from PubChem (CID 123302661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).