2-phenyl-1H-pyrrolo[3,2-f]quinoxaline

C16H11N3 — CID 167437473

IUPAC2-phenyl-1H-pyrrolo[3,2-f]quinoxaline
SMILESc1ccc(-c2cnc3ccc4nccc4c3[nH]2)cc1
InChIInChI=1S/C16H11N3/c1-2-4-11(5-3-1)15-10-18-14-7-6-13-12(8-9-17-13)16(14)19-15/h1-10,19H
InChIKeyQTXTYQTZGRQAOI-UHFFFAOYSA-N
MW245.29 g/mol
LogP3.78
Rot. Bonds1

About 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline

2-phenyl-1H-pyrrolo[3,2-f]quinoxaline (PubChem CID 167437473) has the molecular formula C16H11N3 and a molecular weight of 245.29 g/mol. Its IUPAC name is 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline.

Molecular Properties

Compound Name2-phenyl-1H-pyrrolo[3,2-f]quinoxaline
PubChem CID167437473
Molecular FormulaC16H11N3
Molecular Weight245.29 g/mol
Exact Mass245.10
IUPAC Name2-phenyl-1H-pyrrolo[3,2-f]quinoxaline
SMILESc1ccc(-c2cnc3ccc4nccc4c3[nH]2)cc1
InChIInChI=1S/C16H11N3/c1-2-4-11(5-3-1)15-10-18-14-7-6-13-12(8-9-17-13)16(14)19-15/h1-10,19H
InChIKeyQTXTYQTZGRQAOI-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-phenyl-1H-pyrrolo[3,2-b]pyridine-7-carboxylic acid
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2-methylsulfanyl-5-phenyl-1H-imidazole
CID 3904984
1-(5-phenyl-1H-imidazol-2-yl)pyrrolo[3,2-b]pyridine
CID 91437172
2,5-diphenyl-1H-imidazole;1H-pyrrole
CID 174802105
5-phenyl-1H-imidazol-2-amine;propane
CID 143872640
2-(chloromethyl)-5-phenyl-1H-imidazole;hydrochloride
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2,7-diphenyl-6H-pyrido[4,3-d]pyrimidin-5-one
CID 131851212
azane;5-phenyl-2-(3-phenylpropyl)-1H-imidazole
CID 174441840
[5-(4-phenylphenyl)-1H-imidazol-2-yl]methanethiol
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5-(4-bromophenyl)-2-phenyl-1H-imidazole
CID 12858161

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline?
The IUPAC name of 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline (CID 167437473) is 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline.
What is the SMILES notation for 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline?
The canonical SMILES for 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline is c1ccc(-c2cnc3ccc4nccc4c3[nH]2)cc1.
What is the InChIKey of 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline?
The InChIKey is QTXTYQTZGRQAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3/c1-2-4-11(5-3-1)15-10-18-14-7-6-13-12(8-9-17-13)16(14)19-15/h1-10,19H.
What are the key properties of 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline?
2-phenyl-1H-pyrrolo[3,2-f]quinoxaline has a molecular weight of 245.29 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1H-pyrrolo[3,2-f]quinoxaline is sourced from PubChem (CID 167437473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).