2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline

C14H13N3 — CID 70254526

IUPAC2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline
SMILESCc1nc2ccccc2nc1-c1cccn1C
InChIInChI=1S/C14H13N3/c1-10-14(13-8-5-9-17(13)2)16-12-7-4-3-6-11(12)15-10/h3-9H,1-2H3
InChIKeyYZUSIDSIBURNPG-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.94
Rot. Bonds1

About 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline

2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline (PubChem CID 70254526) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline.

Molecular Properties

Compound Name2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline
PubChem CID70254526
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline
SMILESCc1nc2ccccc2nc1-c1cccn1C
InChIInChI=1S/C14H13N3/c1-10-14(13-8-5-9-17(13)2)16-12-7-4-3-6-11(12)15-10/h3-9H,1-2H3
InChIKeyYZUSIDSIBURNPG-UHFFFAOYSA-N
XLogP2.94
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline?
The IUPAC name of 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline (CID 70254526) is 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline.
What is the SMILES notation for 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline?
The canonical SMILES for 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline is Cc1nc2ccccc2nc1-c1cccn1C.
What is the InChIKey of 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline?
The InChIKey is YZUSIDSIBURNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-10-14(13-8-5-9-17(13)2)16-12-7-4-3-6-11(12)15-10/h3-9H,1-2H3.
What are the key properties of 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline?
2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline has a molecular weight of 223.28 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1-methylpyrrol-2-yl)quinoxaline is sourced from PubChem (CID 70254526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).