N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide

C16H19F2N3O2 — CID 82157587

IUPACN-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide
SMILESO=C(CN1C(=O)CNc2cc(F)c(F)cc21)NC1CCCCC1
InChIInChI=1S/C16H19F2N3O2/c17-11-6-13-14(7-12(11)18)21(16(23)8-19-13)9-15(22)20-10-4-2-1-3-5-10/h6-7,10,19H,1-5,8-9H2,(H,20,22)
InChIKeyPIDTXCFDPZKZOL-UHFFFAOYSA-N
MW323.34 g/mol
LogP2.17
Rot. Bonds3

About N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide

N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide (PubChem CID 82157587) has the molecular formula C16H19F2N3O2 and a molecular weight of 323.34 g/mol. Its IUPAC name is N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide
PubChem CID82157587
Molecular FormulaC16H19F2N3O2
Molecular Weight323.34 g/mol
Exact Mass323.14
IUPAC NameN-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide
SMILESO=C(CN1C(=O)CNc2cc(F)c(F)cc21)NC1CCCCC1
InChIInChI=1S/C16H19F2N3O2/c17-11-6-13-14(7-12(11)18)21(16(23)8-19-13)9-15(22)20-10-4-2-1-3-5-10/h6-7,10,19H,1-5,8-9H2,(H,20,22)
InChIKeyPIDTXCFDPZKZOL-UHFFFAOYSA-N
XLogP2.17
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)-N-methylacetamide
CID 82157627
2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-N-cyclopentylacetamide
CID 23410828
2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 94765439
N-cyclopentyl-2-(7-hydroxy-3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 82063564
N-cyclohexyl-2-(6-ethylsulfonyl-3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 95917193
2-(5-chloro-1,3-dioxoisoindol-2-yl)-N-cyclohexylacetamide
CID 113201443
2-(2,5-dioxoimidazolidin-1-yl)-N-[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 97136714
2-(2,5-dioxoimidazolidin-1-yl)-N-[(3S)-1-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]acetamide
CID 97136715
N-cyclooctyl-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51250040
N-cyclohexyl-2-(3-cyclopropyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 87022438
N-cycloheptyl-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
CID 51138945
N-cyclohexyl-2-[(4S)-4-(2-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 94815011

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide (CID 82157587) is N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide is O=C(CN1C(=O)CNc2cc(F)c(F)cc21)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide?
The InChIKey is PIDTXCFDPZKZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F2N3O2/c17-11-6-13-14(7-12(11)18)21(16(23)8-19-13)9-15(22)20-10-4-2-1-3-5-10/h6-7,10,19H,1-5,8-9H2,(H,20,22).
What are the key properties of N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide?
N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide has a molecular weight of 323.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(6,7-difluoro-2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide is sourced from PubChem (CID 82157587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).