6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline

C19H13FN4 — CID 122478586

IUPAC6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline
SMILESCc1nc(-c2ncccc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C19H13FN4/c1-12-15(20)5-7-17(24-12)19-14(3-2-8-23-19)13-4-6-16-18(11-13)22-10-9-21-16/h2-11H,1H3
InChIKeyQJVYVPBFPPDGEP-UHFFFAOYSA-N
MW316.34 g/mol
LogP4.20
Rot. Bonds2

About 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline

6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline (PubChem CID 122478586) has the molecular formula C19H13FN4 and a molecular weight of 316.34 g/mol. Its IUPAC name is 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline.

Molecular Properties

Compound Name6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline
PubChem CID122478586
Molecular FormulaC19H13FN4
Molecular Weight316.34 g/mol
Exact Mass316.11
IUPAC Name6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline
SMILESCc1nc(-c2ncccc2-c2ccc3nccnc3c2)ccc1F
InChIInChI=1S/C19H13FN4/c1-12-15(20)5-7-17(24-12)19-14(3-2-8-23-19)13-4-6-16-18(11-13)22-10-9-21-16/h2-11H,1H3
InChIKeyQJVYVPBFPPDGEP-UHFFFAOYSA-N
XLogP4.20
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.34
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline?
The IUPAC name of 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline (CID 122478586) is 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline.
What is the SMILES notation for 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline?
The canonical SMILES for 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline is Cc1nc(-c2ncccc2-c2ccc3nccnc3c2)ccc1F.
What is the InChIKey of 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline?
The InChIKey is QJVYVPBFPPDGEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4/c1-12-15(20)5-7-17(24-12)19-14(3-2-8-23-19)13-4-6-16-18(11-13)22-10-9-21-16/h2-11H,1H3.
What are the key properties of 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline?
6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline has a molecular weight of 316.34 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]quinoxaline is sourced from PubChem (CID 122478586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).