N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide

C19H17FN4O — CID 10735588

IUPACN-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
SMILESCCNC(=O)N1Cc2c(-c3ccc(F)cc3)ncn2-c2ccccc21
InChIInChI=1S/C19H17FN4O/c1-2-21-19(25)23-11-17-18(13-7-9-14(20)10-8-13)22-12-24(17)16-6-4-3-5-15(16)23/h3-10,12H,2,11H2,1H3,(H,21,25)
InChIKeyMSOQDCOFVHDPJZ-UHFFFAOYSA-N
MW336.37 g/mol
LogP3.73
Rot. Bonds2

About N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide

N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide (PubChem CID 10735588) has the molecular formula C19H17FN4O and a molecular weight of 336.37 g/mol. Its IUPAC name is N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
PubChem CID10735588
Molecular FormulaC19H17FN4O
Molecular Weight336.37 g/mol
Exact Mass336.14
IUPAC NameN-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide
SMILESCCNC(=O)N1Cc2c(-c3ccc(F)cc3)ncn2-c2ccccc21
InChIInChI=1S/C19H17FN4O/c1-2-21-19(25)23-11-17-18(13-7-9-14(20)10-8-13)22-12-24(17)16-6-4-3-5-15(16)23/h3-10,12H,2,11H2,1H3,(H,21,25)
InChIKeyMSOQDCOFVHDPJZ-UHFFFAOYSA-N
XLogP3.73
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The IUPAC name of N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide (CID 10735588) is N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide.
What is the SMILES notation for N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The canonical SMILES for N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide is CCNC(=O)N1Cc2c(-c3ccc(F)cc3)ncn2-c2ccccc21.
What is the InChIKey of N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
The InChIKey is MSOQDCOFVHDPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O/c1-2-21-19(25)23-11-17-18(13-7-9-14(20)10-8-13)22-12-24(17)16-6-4-3-5-15(16)23/h3-10,12H,2,11H2,1H3,(H,21,25).
What are the key properties of N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide?
N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide has a molecular weight of 336.37 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(4-fluorophenyl)-4H-imidazo[1,5-a]quinoxaline-5-carboxamide is sourced from PubChem (CID 10735588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).