N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide

C20H22N2O3S — CID 26545265

IUPACN-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NCC(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O3S/c1-15-19(16(2)25-22-15)26(23,24)21-14-20(3,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,21H,14H2,1-3H3
InChIKeyMHYCHSSIRZBXNZ-UHFFFAOYSA-N
MW370.47 g/mol
LogP3.58
Rot. Bonds6

About N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide

N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide (PubChem CID 26545265) has the molecular formula C20H22N2O3S and a molecular weight of 370.47 g/mol. Its IUPAC name is N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
PubChem CID26545265
Molecular FormulaC20H22N2O3S
Molecular Weight370.47 g/mol
Exact Mass370.14
IUPAC NameN-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NCC(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O3S/c1-15-19(16(2)25-22-15)26(23,24)21-14-20(3,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,21H,14H2,1-3H3
InChIKeyMHYCHSSIRZBXNZ-UHFFFAOYSA-N
XLogP3.58
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.47
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dimethyl-N-[(2R)-3,3,3-trifluoro-2-hydroxy-2-phenylpropyl]-1,2-oxazole-4-sulfonamide
CID 95376531
N-(2-amino-2-methylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide;hydrochloride
CID 119988108
N-[2-(4-chlorophenyl)-2-methylpropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 113090418
N-(2-hydroxy-2-methylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 65113388
N-[2-(2-fluorophenyl)-2-methoxypropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 71810666
N-[2-(4-bromophenyl)-2-hydroxypropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 110291682
N-[(2R)-2-hydroxy-2-thiophen-3-ylpropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 97065958
N-[(2S)-2-(1-benzofuran-2-yl)-2-hydroxypropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 100000000
N-[2-(1,3-benzodioxol-5-yl)-2-methylpropyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 86870479
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 93157673
3,5-dimethyl-N-[[3-(trifluoromethyl)phenyl]methyl]-1,2-oxazole-4-sulfonamide
CID 3863030
3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-[(1S)-1-phenylethyl]propanamide
CID 9032989

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The IUPAC name of N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide (CID 26545265) is N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The canonical SMILES for N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is Cc1noc(C)c1S(=O)(=O)NCC(C)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
The InChIKey is MHYCHSSIRZBXNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3S/c1-15-19(16(2)25-22-15)26(23,24)21-14-20(3,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,21H,14H2,1-3H3.
What are the key properties of N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide?
N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide has a molecular weight of 370.47 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diphenylpropyl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 26545265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).