8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline

C12H11ClN2 — CID 164616153

IUPAC8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline
SMILESCC1Nc2ccc(Cl)cc2-n2cccc21
InChIInChI=1S/C12H11ClN2/c1-8-11-3-2-6-15(11)12-7-9(13)4-5-10(12)14-8/h2-8,14H,1H3
InChIKeyJMPCNHZNRPOGSV-UHFFFAOYSA-N
MW218.69 g/mol
LogP3.62
Rot. Bonds

About 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline

8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline (PubChem CID 164616153) has the molecular formula C12H11ClN2 and a molecular weight of 218.69 g/mol. Its IUPAC name is 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline
PubChem CID164616153
Molecular FormulaC12H11ClN2
Molecular Weight218.69 g/mol
Exact Mass218.06
IUPAC Name8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline
SMILESCC1Nc2ccc(Cl)cc2-n2cccc21
InChIInChI=1S/C12H11ClN2/c1-8-11-3-2-6-15(11)12-7-9(13)4-5-10(12)14-8/h2-8,14H,1H3
InChIKeyJMPCNHZNRPOGSV-UHFFFAOYSA-N
XLogP3.62
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.69
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The IUPAC name of 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline (CID 164616153) is 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline.
What is the SMILES notation for 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The canonical SMILES for 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline is CC1Nc2ccc(Cl)cc2-n2cccc21.
What is the InChIKey of 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline?
The InChIKey is JMPCNHZNRPOGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2/c1-8-11-3-2-6-15(11)12-7-9(13)4-5-10(12)14-8/h2-8,14H,1H3.
What are the key properties of 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline?
8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline has a molecular weight of 218.69 g/mol, XLogP of 3.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-4-methyl-4,5-dihydropyrrolo[1,2-a]quinoxaline is sourced from PubChem (CID 164616153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).