N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide

C16H16FN3O — CID 46382953

IUPACN-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCN1CCN(C(=O)Nc2ccccc2F)c2ccccc21
InChIInChI=1S/C16H16FN3O/c1-19-10-11-20(15-9-5-4-8-14(15)19)16(21)18-13-7-3-2-6-12(13)17/h2-9H,10-11H2,1H3,(H,18,21)
InChIKeyDLDZHYOXFGXZOI-UHFFFAOYSA-N
MW285.32 g/mol
LogP3.31
Rot. Bonds1

About N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide

N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (PubChem CID 46382953) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
PubChem CID46382953
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC NameN-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
SMILESCN1CCN(C(=O)Nc2ccccc2F)c2ccccc21
InChIInChI=1S/C16H16FN3O/c1-19-10-11-20(15-9-5-4-8-14(15)19)16(21)18-13-7-3-2-6-12(13)17/h2-9H,10-11H2,1H3,(H,18,21)
InChIKeyDLDZHYOXFGXZOI-UHFFFAOYSA-N
XLogP3.31
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 6468631
4-methyl-2,3-dihydroquinoxaline-1-carbohydrazide
CID 63776473
4-methyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydroquinoxaline-1-carboxamide
CID 46382952
N-(3-methoxyphenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide
CID 46382930
6-amino-N-(2-fluorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
CID 61037785
2-hydroxy-3-[(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)amino]propanoic acid
CID 66166560
(2-fluoro-4-hydroxyphenyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 107676708
4-fluoro-N-(2-fluorophenyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroindole-1-carboxamide
CID 178092772
methyl 2-[(4-methyl-2,3-dihydropyrido[2,3-b]pyrazine-1-carbonyl)amino]benzoate
CID 53071730
(3R,4S)-N-(2-fluorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79410579
N-(2-fluorophenyl)-2-methyl-4H-quinoline-1-carboxamide
CID 22474638
(3R)-N-(2-fluorophenyl)-3-methylpiperidine-1-carboxamide
CID 41097666

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide (CID 46382953) is N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is CN1CCN(C(=O)Nc2ccccc2F)c2ccccc21.
What is the InChIKey of N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
The InChIKey is DLDZHYOXFGXZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c1-19-10-11-20(15-9-5-4-8-14(15)19)16(21)18-13-7-3-2-6-12(13)17/h2-9H,10-11H2,1H3,(H,18,21).
What are the key properties of N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide?
N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide has a molecular weight of 285.32 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-methyl-2,3-dihydroquinoxaline-1-carboxamide is sourced from PubChem (CID 46382953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).