2-chloro-5,6-difluoro-3-methylquinoxaline

C9H5ClF2N2 — CID 86712408

IUPAC2-chloro-5,6-difluoro-3-methylquinoxaline
SMILESCc1nc2c(F)c(F)ccc2nc1Cl
InChIInChI=1S/C9H5ClF2N2/c1-4-9(10)14-6-3-2-5(11)7(12)8(6)13-4/h2-3H,1H3
InChIKeyFUAUAJUFSWWDBS-UHFFFAOYSA-N
MW214.60 g/mol
LogP2.87
Rot. Bonds

About 2-chloro-5,6-difluoro-3-methylquinoxaline

2-chloro-5,6-difluoro-3-methylquinoxaline (PubChem CID 86712408) has the molecular formula C9H5ClF2N2 and a molecular weight of 214.60 g/mol. Its IUPAC name is 2-chloro-5,6-difluoro-3-methylquinoxaline.

Molecular Properties

Compound Name2-chloro-5,6-difluoro-3-methylquinoxaline
PubChem CID86712408
Molecular FormulaC9H5ClF2N2
Molecular Weight214.60 g/mol
Exact Mass214.01
IUPAC Name2-chloro-5,6-difluoro-3-methylquinoxaline
SMILESCc1nc2c(F)c(F)ccc2nc1Cl
InChIInChI=1S/C9H5ClF2N2/c1-4-9(10)14-6-3-2-5(11)7(12)8(6)13-4/h2-3H,1H3
InChIKeyFUAUAJUFSWWDBS-UHFFFAOYSA-N
XLogP2.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.60
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5,6-difluoro-3-methylquinoxaline?
The IUPAC name of 2-chloro-5,6-difluoro-3-methylquinoxaline (CID 86712408) is 2-chloro-5,6-difluoro-3-methylquinoxaline.
What is the SMILES notation for 2-chloro-5,6-difluoro-3-methylquinoxaline?
The canonical SMILES for 2-chloro-5,6-difluoro-3-methylquinoxaline is Cc1nc2c(F)c(F)ccc2nc1Cl.
What is the InChIKey of 2-chloro-5,6-difluoro-3-methylquinoxaline?
The InChIKey is FUAUAJUFSWWDBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClF2N2/c1-4-9(10)14-6-3-2-5(11)7(12)8(6)13-4/h2-3H,1H3.
What are the key properties of 2-chloro-5,6-difluoro-3-methylquinoxaline?
2-chloro-5,6-difluoro-3-methylquinoxaline has a molecular weight of 214.60 g/mol, XLogP of 2.87, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5,6-difluoro-3-methylquinoxaline is sourced from PubChem (CID 86712408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).