N-benzhydryl-2-hydroxyethanesulfonamide

C15H17NO3S — CID 79589039

IUPACN-benzhydryl-2-hydroxyethanesulfonamide
SMILESO=S(=O)(CCO)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17NO3S/c17-11-12-20(18,19)16-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-17H,11-12H2
InChIKeyQFAGTLFSFIASNN-UHFFFAOYSA-N
MW291.37 g/mol
LogP1.69
Rot. Bonds6

About N-benzhydryl-2-hydroxyethanesulfonamide

N-benzhydryl-2-hydroxyethanesulfonamide (PubChem CID 79589039) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is N-benzhydryl-2-hydroxyethanesulfonamide.

Molecular Properties

Compound NameN-benzhydryl-2-hydroxyethanesulfonamide
PubChem CID79589039
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC NameN-benzhydryl-2-hydroxyethanesulfonamide
SMILESO=S(=O)(CCO)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H17NO3S/c17-11-12-20(18,19)16-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-17H,11-12H2
InChIKeyQFAGTLFSFIASNN-UHFFFAOYSA-N
XLogP1.69
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-benzhydryl-2-hydroxyethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzhydryl-1-chloromethanesulfonamide
CID 63664660
N-benzhydryl-2-(diethylamino)ethanesulfonamide
CID 100762604
N-benzhydryl-2-(4-fluorophenoxy)ethanesulfonamide
CID 90518568
N-[(1R)-3-hydroxy-1-phenylpropyl]ethanesulfonamide
CID 111448440
N-(4-hydroxy-1-phenylbutyl)propane-1-sulfonamide
CID 111448436
2-hydroxy-N-(1-pyridin-3-ylethyl)ethanesulfonamide
CID 79588957
N-[2-(diethylamino)-2-phenylethyl]-2-hydroxyethanesulfonamide
CID 79588864
3-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]propane-1-sulfonamide
CID 107863619
2-[[furan-2-yl(phenyl)methyl]sulfamoyl]acetic acid
CID 60780500
(2S)-2-(2-methylsulfonylethylsulfonylamino)-2-phenylacetic acid
CID 103862434
N-[(1S)-2-methyl-1-phenylpropyl]ethanesulfonamide
CID 94197100
(2S)-N-[(S)-(3-fluorophenyl)-phenylmethyl]-2-methoxypropane-1-sulfonamide
CID 99843822

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-2-hydroxyethanesulfonamide?
The IUPAC name of N-benzhydryl-2-hydroxyethanesulfonamide (CID 79589039) is N-benzhydryl-2-hydroxyethanesulfonamide.
What is the SMILES notation for N-benzhydryl-2-hydroxyethanesulfonamide?
The canonical SMILES for N-benzhydryl-2-hydroxyethanesulfonamide is O=S(=O)(CCO)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-2-hydroxyethanesulfonamide?
The InChIKey is QFAGTLFSFIASNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c17-11-12-20(18,19)16-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-17H,11-12H2.
What are the key properties of N-benzhydryl-2-hydroxyethanesulfonamide?
N-benzhydryl-2-hydroxyethanesulfonamide has a molecular weight of 291.37 g/mol, XLogP of 1.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-2-hydroxyethanesulfonamide is sourced from PubChem (CID 79589039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).