N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide

C25H26N2O4S — CID 17147844

IUPACN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O4S/c28-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)27-21-13-15-23(16-14-21)32(29,30)26-18-22-12-7-17-31-22/h1-6,8-11,13-16,22,24,26H,7,12,17-18H2,(H,27,28)
InChIKeyXOSANCNLNHPWLH-UHFFFAOYSA-N
MW450.56 g/mol
LogP3.91
Rot. Bonds8

About N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide

N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide (PubChem CID 17147844) has the molecular formula C25H26N2O4S and a molecular weight of 450.56 g/mol. Its IUPAC name is N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide
PubChem CID17147844
Molecular FormulaC25H26N2O4S
Molecular Weight450.56 g/mol
Exact Mass450.16
IUPAC NameN-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide
SMILESO=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O4S/c28-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)27-21-13-15-23(16-14-21)32(29,30)26-18-22-12-7-17-31-22/h1-6,8-11,13-16,22,24,26H,7,12,17-18H2,(H,27,28)
InChIKeyXOSANCNLNHPWLH-UHFFFAOYSA-N
XLogP3.91
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.56
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(benzenesulfonamido)-N-[[(2S)-oxolan-2-yl]methyl]benzenesulfonamide
CID 1025633
N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-3-phenylpropanamide
CID 23722959
2-fluoro-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 1094176
3-(2-methylpropanoylamino)-N-[4-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 1094236
N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 17161277
2,6-dichloro-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]benzamide
CID 3158279
2-oxo-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]chromene-3-carboxamide
CID 1137148
3-(2-ethylbutanoylamino)-N-[4-[[(2R)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 41300861
4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzoic acid
CID 796841
N-[3-oxo-3-[4-(oxolan-2-ylmethylsulfamoyl)anilino]propyl]benzamide
CID 17154597
3-fluoro-N-[4-[[(2S)-oxolan-2-yl]methylsulfamoyl]phenyl]benzamide
CID 1094225
3-benzylsulfonyl-N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]propanamide
CID 2974345

Frequently Asked Questions

What is the IUPAC name of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide (CID 17147844) is N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide is O=C(Nc1ccc(S(=O)(=O)NCC2CCCO2)cc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide?
The InChIKey is XOSANCNLNHPWLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4S/c28-25(24(19-8-3-1-4-9-19)20-10-5-2-6-11-20)27-21-13-15-23(16-14-21)32(29,30)26-18-22-12-7-17-31-22/h1-6,8-11,13-16,22,24,26H,7,12,17-18H2,(H,27,28).
What are the key properties of N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide?
N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide has a molecular weight of 450.56 g/mol, XLogP of 3.91, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(oxolan-2-ylmethylsulfamoyl)phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 17147844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).