2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine

C15H15FN2 — CID 167219286

IUPAC2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine
SMILESCCc1ccc(F)c(-c2cnc(C3CC3)cn2)c1
InChIInChI=1S/C15H15FN2/c1-2-10-3-6-13(16)12(7-10)15-9-17-14(8-18-15)11-4-5-11/h3,6-9,11H,2,4-5H2,1H3
InChIKeyULGAMPGMASDTND-UHFFFAOYSA-N
MW242.30 g/mol
LogP3.72
Rot. Bonds3

About 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine

2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine (PubChem CID 167219286) has the molecular formula C15H15FN2 and a molecular weight of 242.30 g/mol. Its IUPAC name is 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine.

Molecular Properties

Compound Name2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine
PubChem CID167219286
Molecular FormulaC15H15FN2
Molecular Weight242.30 g/mol
Exact Mass242.12
IUPAC Name2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine
SMILESCCc1ccc(F)c(-c2cnc(C3CC3)cn2)c1
InChIInChI=1S/C15H15FN2/c1-2-10-3-6-13(16)12(7-10)15-9-17-14(8-18-15)11-4-5-11/h3,6-9,11H,2,4-5H2,1H3
InChIKeyULGAMPGMASDTND-UHFFFAOYSA-N
XLogP3.72
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine?
The IUPAC name of 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine (CID 167219286) is 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine.
What is the SMILES notation for 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine?
The canonical SMILES for 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine is CCc1ccc(F)c(-c2cnc(C3CC3)cn2)c1.
What is the InChIKey of 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine?
The InChIKey is ULGAMPGMASDTND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2/c1-2-10-3-6-13(16)12(7-10)15-9-17-14(8-18-15)11-4-5-11/h3,6-9,11H,2,4-5H2,1H3.
What are the key properties of 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine?
2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine has a molecular weight of 242.30 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-(5-ethyl-2-fluorophenyl)pyrazine is sourced from PubChem (CID 167219286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).