N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide

C17H19FN2O3S — CID 110362709

IUPACN-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)Nc1cc(N2CCOCC2)ccc1F
InChIInChI=1S/C17H19FN2O3S/c1-13-4-2-3-5-17(13)24(21,22)19-16-12-14(6-7-15(16)18)20-8-10-23-11-9-20/h2-7,12,19H,8-11H2,1H3
InChIKeyFLKOWKBRYDJDKT-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.77
Rot. Bonds4

About N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide

N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide (PubChem CID 110362709) has the molecular formula C17H19FN2O3S and a molecular weight of 350.42 g/mol. Its IUPAC name is N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide
PubChem CID110362709
Molecular FormulaC17H19FN2O3S
Molecular Weight350.42 g/mol
Exact Mass350.11
IUPAC NameN-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)Nc1cc(N2CCOCC2)ccc1F
InChIInChI=1S/C17H19FN2O3S/c1-13-4-2-3-5-17(13)24(21,22)19-16-12-14(6-7-15(16)18)20-8-10-23-11-9-20/h2-7,12,19H,8-11H2,1H3
InChIKeyFLKOWKBRYDJDKT-UHFFFAOYSA-N
XLogP2.77
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluoro-5-morpholin-4-ylphenyl)-4-methoxy-2,6-dimethylbenzenesulfonamide
CID 110362702
N-(2-methyl-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362516
2-fluoro-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 7938967
N-(2-fluoro-5-morpholin-4-ylphenyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 110362713
4-fluoro-3-[(2-methylphenyl)sulfonylamino]benzoic acid
CID 63000199
3-[(2-methylphenyl)sulfonylamino]-4-morpholin-4-ylbenzoic acid
CID 50767039
N-[5-(4-formylpiperazin-1-yl)-2-methoxyphenyl]-2-methylbenzenesulfonamide
CID 110604584
N-[2-(benzenesulfonamido)-4-piperazin-1-ylphenyl]-2-methylbenzenesulfonamide;hydrochloride
CID 22272444
4-[4-(4-fluorophenyl)piperazin-1-yl]-3-[(2-methylphenyl)sulfonylamino]benzoic acid
CID 46291912
N-(2-chloro-5-morpholin-4-ylphenyl)benzenesulfonamide
CID 110362791
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylpropanamide
CID 110362575
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-phenylacetamide
CID 110362608

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide?
The IUPAC name of N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide (CID 110362709) is N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide.
What is the SMILES notation for N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide?
The canonical SMILES for N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide is Cc1ccccc1S(=O)(=O)Nc1cc(N2CCOCC2)ccc1F.
What is the InChIKey of N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide?
The InChIKey is FLKOWKBRYDJDKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O3S/c1-13-4-2-3-5-17(13)24(21,22)19-16-12-14(6-7-15(16)18)20-8-10-23-11-9-20/h2-7,12,19H,8-11H2,1H3.
What are the key properties of N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide?
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide has a molecular weight of 350.42 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-morpholin-4-ylphenyl)-2-methylbenzenesulfonamide is sourced from PubChem (CID 110362709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).