N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide

C22H20F2N4O4S — CID 71538187

IUPACN-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide
SMILESO=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1c(F)ccc(NS(=O)(=O)C2CC2)c1F
InChIInChI=1S/C22H20F2N4O4S/c23-15-4-6-17(27-33(30,31)14-2-3-14)21(24)20(15)22(29)13-1-5-16-18(11-13)26-19(12-25-16)28-7-9-32-10-8-28/h1,4-6,11-12,14,27H,2-3,7-10H2
InChIKeyGTXAMISSEKJUKY-UHFFFAOYSA-N
MW474.49 g/mol
LogP2.88
Rot. Bonds6

About N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide

N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide (PubChem CID 71538187) has the molecular formula C22H20F2N4O4S and a molecular weight of 474.49 g/mol. Its IUPAC name is N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide
PubChem CID71538187
Molecular FormulaC22H20F2N4O4S
Molecular Weight474.49 g/mol
Exact Mass474.12
IUPAC NameN-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide
SMILESO=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1c(F)ccc(NS(=O)(=O)C2CC2)c1F
InChIInChI=1S/C22H20F2N4O4S/c23-15-4-6-17(27-33(30,31)14-2-3-14)21(24)20(15)22(29)13-1-5-16-18(11-13)26-19(12-25-16)28-7-9-32-10-8-28/h1,4-6,11-12,14,27H,2-3,7-10H2
InChIKeyGTXAMISSEKJUKY-UHFFFAOYSA-N
XLogP2.88
TPSA101.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.49
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide with MolForge

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Related Compounds

N-[4-chloro-2-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-3,4-difluorobenzamide
CID 89445006
N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]propane-1-sulfonamide
CID 71268676
(2-fluoro-5-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
CID 89478345
bis(2-morpholin-4-ylquinoxalin-6-yl)methanone
CID 151491691
N-[4-chloro-2-fluoro-3-(3-pyrrolidin-1-ylquinoxaline-6-carbonyl)phenyl]propane-1-sulfonamide
CID 71537325
N-[2,4-difluoro-3-(3-piperazin-1-ylquinoxaline-6-carbonyl)phenyl]-3-fluorobenzamide
CID 89444097
3-chloro-N-[3,4-difluoro-5-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]-4-fluorobenzamide
CID 89445214
N-[2,4-difluoro-3-[3-(4-methylimidazol-1-yl)quinoxaline-6-carbonyl]phenyl]propane-1-sulfonamide
CID 71268652
4-[7-[2,3-difluoro-5-[3-(sulfinoamino)propyl]benzoyl]quinoxalin-2-yl]morpholine
CID 71282402
4-chloro-3-fluoro-N-[4-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89443057
4-chloro-3-fluoro-N-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89445010
1-(4-chloro-3-fluorophenyl)-3-[2-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]urea
CID 89443365

Frequently Asked Questions

What is the IUPAC name of N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide?
The IUPAC name of N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide (CID 71538187) is N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide?
The canonical SMILES for N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide is O=C(c1ccc2ncc(N3CCOCC3)nc2c1)c1c(F)ccc(NS(=O)(=O)C2CC2)c1F.
What is the InChIKey of N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide?
The InChIKey is GTXAMISSEKJUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F2N4O4S/c23-15-4-6-17(27-33(30,31)14-2-3-14)21(24)20(15)22(29)13-1-5-16-18(11-13)26-19(12-25-16)28-7-9-32-10-8-28/h1,4-6,11-12,14,27H,2-3,7-10H2.
What are the key properties of N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide?
N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide has a molecular weight of 474.49 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-difluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]cyclopropanesulfonamide is sourced from PubChem (CID 71538187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).