N-(4-ethoxyphenyl)quinoxaline-6-carboxamide

C17H15N3O2 — CID 858920

IUPACN-(4-ethoxyphenyl)quinoxaline-6-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
InChIInChI=1S/C17H15N3O2/c1-2-22-14-6-4-13(5-7-14)20-17(21)12-3-8-15-16(11-12)19-10-9-18-15/h3-11H,2H2,1H3,(H,20,21)
InChIKeyWVCQNULTWANDSC-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.28
Rot. Bonds4

About N-(4-ethoxyphenyl)quinoxaline-6-carboxamide

N-(4-ethoxyphenyl)quinoxaline-6-carboxamide (PubChem CID 858920) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)quinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)quinoxaline-6-carboxamide
PubChem CID858920
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-(4-ethoxyphenyl)quinoxaline-6-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc3nccnc3c2)cc1
InChIInChI=1S/C17H15N3O2/c1-2-22-14-6-4-13(5-7-14)20-17(21)12-3-8-15-16(11-12)19-10-9-18-15/h3-11H,2H2,1H3,(H,20,21)
InChIKeyWVCQNULTWANDSC-UHFFFAOYSA-N
XLogP3.28
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)quinoxaline-6-carboxamide?
The IUPAC name of N-(4-ethoxyphenyl)quinoxaline-6-carboxamide (CID 858920) is N-(4-ethoxyphenyl)quinoxaline-6-carboxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)quinoxaline-6-carboxamide?
The canonical SMILES for N-(4-ethoxyphenyl)quinoxaline-6-carboxamide is CCOc1ccc(NC(=O)c2ccc3nccnc3c2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)quinoxaline-6-carboxamide?
The InChIKey is WVCQNULTWANDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-2-22-14-6-4-13(5-7-14)20-17(21)12-3-8-15-16(11-12)19-10-9-18-15/h3-11H,2H2,1H3,(H,20,21).
What are the key properties of N-(4-ethoxyphenyl)quinoxaline-6-carboxamide?
N-(4-ethoxyphenyl)quinoxaline-6-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)quinoxaline-6-carboxamide is sourced from PubChem (CID 858920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).