2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline

C12H11N3 — CID 638710

IUPAC2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline
SMILESCc1nc2c(ccc3ccnc32)[nH]c1C
InChIInChI=1S/C12H11N3/c1-7-8(2)15-12-10(14-7)4-3-9-5-6-13-11(9)12/h3-6,14H,1-2H3
InChIKeyWTLITTGNRLXQQN-UHFFFAOYSA-N
MW197.24 g/mol
LogP2.73
Rot. Bonds

About 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline

2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline (PubChem CID 638710) has the molecular formula C12H11N3 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline.

Molecular Properties

Compound Name2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline
PubChem CID638710
Molecular FormulaC12H11N3
Molecular Weight197.24 g/mol
Exact Mass197.10
IUPAC Name2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline
SMILESCc1nc2c(ccc3ccnc32)[nH]c1C
InChIInChI=1S/C12H11N3/c1-7-8(2)15-12-10(14-7)4-3-9-5-6-13-11(9)12/h3-6,14H,1-2H3
InChIKeyWTLITTGNRLXQQN-UHFFFAOYSA-N
XLogP2.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline?
The IUPAC name of 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline (CID 638710) is 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline.
What is the SMILES notation for 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline?
The canonical SMILES for 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline is Cc1nc2c(ccc3ccnc32)[nH]c1C.
What is the InChIKey of 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline?
The InChIKey is WTLITTGNRLXQQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3/c1-7-8(2)15-12-10(14-7)4-3-9-5-6-13-11(9)12/h3-6,14H,1-2H3.
What are the key properties of 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline?
2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline has a molecular weight of 197.24 g/mol, XLogP of 2.73, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4H-pyrrolo[2,3-f]quinoxaline is sourced from PubChem (CID 638710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).