4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline

C17H11ClN2O — CID 1471612

IUPAC4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline
SMILESClc1ccc(Oc2nc3ccccc3n3cccc23)cc1
InChIInChI=1S/C17H11ClN2O/c18-12-7-9-13(10-8-12)21-17-16-6-3-11-20(16)15-5-2-1-4-14(15)19-17/h1-11H
InChIKeyVSWHPVJRFPZWNZ-UHFFFAOYSA-N
MW294.74 g/mol
LogP4.93
Rot. Bonds2

About 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline

4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline (PubChem CID 1471612) has the molecular formula C17H11ClN2O and a molecular weight of 294.74 g/mol. Its IUPAC name is 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline
PubChem CID1471612
Molecular FormulaC17H11ClN2O
Molecular Weight294.74 g/mol
Exact Mass294.06
IUPAC Name4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline
SMILESClc1ccc(Oc2nc3ccccc3n3cccc23)cc1
InChIInChI=1S/C17H11ClN2O/c18-12-7-9-13(10-8-12)21-17-16-6-3-11-20(16)15-5-2-1-4-14(15)19-17/h1-11H
InChIKeyVSWHPVJRFPZWNZ-UHFFFAOYSA-N
XLogP4.93
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.74
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline?
The IUPAC name of 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline (CID 1471612) is 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline.
What is the SMILES notation for 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline?
The canonical SMILES for 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline is Clc1ccc(Oc2nc3ccccc3n3cccc23)cc1.
What is the InChIKey of 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline?
The InChIKey is VSWHPVJRFPZWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN2O/c18-12-7-9-13(10-8-12)21-17-16-6-3-11-20(16)15-5-2-1-4-14(15)19-17/h1-11H.
What are the key properties of 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline?
4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline has a molecular weight of 294.74 g/mol, XLogP of 4.93, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenoxy)pyrrolo[1,2-a]quinoxaline is sourced from PubChem (CID 1471612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).