N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide

C17H17FN2O4S — CID 1157332

IUPACN-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H17FN2O4S/c18-14-3-5-15(6-4-14)19-17(21)13-1-7-16(8-2-13)25(22,23)20-9-11-24-12-10-20/h1-8H,9-12H2,(H,19,21)
InChIKeyPXJZPNSHQNXWOH-UHFFFAOYSA-N
MW364.40 g/mol
LogP2.10
Rot. Bonds4

About N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide

N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide (PubChem CID 1157332) has the molecular formula C17H17FN2O4S and a molecular weight of 364.40 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide
PubChem CID1157332
Molecular FormulaC17H17FN2O4S
Molecular Weight364.40 g/mol
Exact Mass364.09
IUPAC NameN-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESO=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H17FN2O4S/c18-14-3-5-15(6-4-14)19-17(21)13-1-7-16(8-2-13)25(22,23)20-9-11-24-12-10-20/h1-8H,9-12H2,(H,19,21)
InChIKeyPXJZPNSHQNXWOH-UHFFFAOYSA-N
XLogP2.10
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-morpholin-4-ylsulfonyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 17391128
N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1152899
4-iodo-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 3955565
N-(4-fluorophenyl)-4-piperidin-1-ylsulfonylbenzamide
CID 2704882
4-morpholin-4-ylsulfonyl-N-(4-nitrophenyl)benzamide
CID 4282639
4-fluoro-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]benzamide
CID 1010611
N-(4-morpholin-4-ylsulfonylphenyl)furan-3-carboxamide
CID 17015677
[4-[(4-morpholin-4-ylsulfonylphenyl)carbamoyl]phenyl] acetate
CID 1164288
4-methyl-N-[4-[2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]ethylcarbamoyl]phenyl]benzamide
CID 121062034
N-(3,5-dimethylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1077896
4-pyrrolidin-1-ylsulfonyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 26252425
4-(acetamidomethyl)-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 43030692

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide (CID 1157332) is N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide is O=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide?
The InChIKey is PXJZPNSHQNXWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O4S/c18-14-3-5-15(6-4-14)19-17(21)13-1-7-16(8-2-13)25(22,23)20-9-11-24-12-10-20/h1-8H,9-12H2,(H,19,21).
What are the key properties of N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide?
N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide has a molecular weight of 364.40 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 1157332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).