N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide

C17H15ClF2N2O4S — CID 26309220

IUPACN-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1cc(S(=O)(=O)N2CCOCC2)ccc1F
InChIInChI=1S/C17H15ClF2N2O4S/c18-13-2-1-3-15(16(13)20)21-17(23)12-10-11(4-5-14(12)19)27(24,25)22-6-8-26-9-7-22/h1-5,10H,6-9H2,(H,21,23)
InChIKeyHADFMSZGFBXJMY-UHFFFAOYSA-N
MW416.83 g/mol
LogP2.89
Rot. Bonds4

About N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide

N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide (PubChem CID 26309220) has the molecular formula C17H15ClF2N2O4S and a molecular weight of 416.83 g/mol. Its IUPAC name is N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
PubChem CID26309220
Molecular FormulaC17H15ClF2N2O4S
Molecular Weight416.83 g/mol
Exact Mass416.04
IUPAC NameN-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1cccc(Cl)c1F)c1cc(S(=O)(=O)N2CCOCC2)ccc1F
InChIInChI=1S/C17H15ClF2N2O4S/c18-13-2-1-3-15(16(13)20)21-17(23)12-10-11(4-5-14(12)19)27(24,25)22-6-8-26-9-7-22/h1-5,10H,6-9H2,(H,21,23)
InChIKeyHADFMSZGFBXJMY-UHFFFAOYSA-N
XLogP2.89
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.83
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-2-fluorophenyl)-5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzamide
CID 43000218
N-[2-(dimethylamino)phenyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 39130389
N-(2,5-dimethylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 2596699
N'-(3-chlorobenzoyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzohydrazide
CID 2578698
N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2,3,4,5-tetrafluorobenzamide
CID 4641528
N-(3-acetylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 9095795
N-(2,4-dichlorophenyl)-2-hydroxy-5-morpholin-4-ylsulfonylbenzamide
CID 43853480
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 24819914
2-chloro-5-morpholin-4-ylsulfonyl-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 28590695
N-(3-chloro-2-fluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 26309208
N-(2-chlorophenyl)-2-methoxy-5-morpholin-4-ylsulfonylbenzamide
CID 18195774
2,5-difluoro-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)benzamide
CID 55375411

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide (CID 26309220) is N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide is O=C(Nc1cccc(Cl)c1F)c1cc(S(=O)(=O)N2CCOCC2)ccc1F.
What is the InChIKey of N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide?
The InChIKey is HADFMSZGFBXJMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClF2N2O4S/c18-13-2-1-3-15(16(13)20)21-17(23)12-10-11(4-5-14(12)19)27(24,25)22-6-8-26-9-7-22/h1-5,10H,6-9H2,(H,21,23).
What are the key properties of N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide?
N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide has a molecular weight of 416.83 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-fluorophenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 26309220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).