N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide

C24H23FN2O5S — CID 42910606

IUPACN-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C24H23FN2O5S/c25-22-8-1-2-9-23(22)27-33(29,30)21-7-3-5-18(15-21)26-24(28)17-10-12-19(13-11-17)32-16-20-6-4-14-31-20/h1-3,5,7-13,15,20,27H,4,6,14,16H2,(H,26,28)
InChIKeyGKTALORJIOOXIA-UHFFFAOYSA-N
MW470.52 g/mol
LogP4.44
Rot. Bonds8

About N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide

N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide (PubChem CID 42910606) has the molecular formula C24H23FN2O5S and a molecular weight of 470.52 g/mol. Its IUPAC name is N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide
PubChem CID42910606
Molecular FormulaC24H23FN2O5S
Molecular Weight470.52 g/mol
Exact Mass470.13
IUPAC NameN-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(OCC2CCCO2)cc1
InChIInChI=1S/C24H23FN2O5S/c25-22-8-1-2-9-23(22)27-33(29,30)21-7-3-5-18(15-21)26-24(28)17-10-12-19(13-11-17)32-16-20-6-4-14-31-20/h1-3,5,7-13,15,20,27H,4,6,14,16H2,(H,26,28)
InChIKeyGKTALORJIOOXIA-UHFFFAOYSA-N
XLogP4.44
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.52
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(benzenesulfonamido)-4-methylphenyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 55705614
4-(oxolan-2-ylmethoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 4314126
1-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-3-[[(2S)-oxolan-2-yl]methyl]thiourea
CID 8614308
4-tert-butyl-N-[3-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]phenyl]benzamide
CID 17232441
2-fluoro-N-[3-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 17141893
4-(oxolan-2-ylmethoxy)-N-[3-(propanoylamino)phenyl]benzamide
CID 17222424
N-naphthalen-1-yl-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580238
N-[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 17222218
3-fluoro-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 42427188
4-[(2-fluorophenyl)sulfamoyl]-N-(oxolan-2-ylmethyl)benzamide
CID 24980882
N-[4-(methanesulfonamido)phenyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 36818148
N-(3,4-dimethylphenyl)-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580258

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide?
The IUPAC name of N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide (CID 42910606) is N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide.
What is the SMILES notation for N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide?
The canonical SMILES for N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide is O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)c1ccc(OCC2CCCO2)cc1.
What is the InChIKey of N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide?
The InChIKey is GKTALORJIOOXIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O5S/c25-22-8-1-2-9-23(22)27-33(29,30)21-7-3-5-18(15-21)26-24(28)17-10-12-19(13-11-17)32-16-20-6-4-14-31-20/h1-3,5,7-13,15,20,27H,4,6,14,16H2,(H,26,28).
What are the key properties of N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide?
N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide has a molecular weight of 470.52 g/mol, XLogP of 4.44, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-4-(oxolan-2-ylmethoxy)benzamide is sourced from PubChem (CID 42910606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).