N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide

C17H18N2O3S2 — CID 20936222

IUPACN-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide
SMILESCCN(c1cccc(C)c1)S(=O)(=O)c1ccc(-c2cc(C)no2)s1
InChIInChI=1S/C17H18N2O3S2/c1-4-19(14-7-5-6-12(2)10-14)24(20,21)17-9-8-16(23-17)15-11-13(3)18-22-15/h5-11H,4H2,1-3H3
InChIKeyGELJBFGLYUGPTD-UHFFFAOYSA-N
MW362.48 g/mol
LogP4.24
Rot. Bonds5

About N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide

N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide (PubChem CID 20936222) has the molecular formula C17H18N2O3S2 and a molecular weight of 362.48 g/mol. Its IUPAC name is N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide
PubChem CID20936222
Molecular FormulaC17H18N2O3S2
Molecular Weight362.48 g/mol
Exact Mass362.08
IUPAC NameN-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide
SMILESCCN(c1cccc(C)c1)S(=O)(=O)c1ccc(-c2cc(C)no2)s1
InChIInChI=1S/C17H18N2O3S2/c1-4-19(14-7-5-6-12(2)10-14)24(20,21)17-9-8-16(23-17)15-11-13(3)18-22-15/h5-11H,4H2,1-3H3
InChIKeyGELJBFGLYUGPTD-UHFFFAOYSA-N
XLogP4.24
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-(3-methylphenyl)-5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophene-2-sulfonamide
CID 68656573
5-bromo-4-chloro-N-ethyl-N-(3-methylphenyl)thiophene-2-sulfonamide
CID 80578542
N-(2-ethoxyphenyl)-5-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 20936262
ethyl 3-[[5-(3-methyl-1,2-oxazol-5-yl)thiophen-2-yl]sulfonylamino]benzoate
CID 20936192
N-ethyl-2-methyl-N-(3-methylphenyl)-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292528
N-(3-aminophenyl)-5-bromo-N-ethylthiophene-2-sulfonamide
CID 63229626
3-tert-butyl-N-ethyl-1-methyl-N-(3-methylphenyl)pyrazole-4-sulfonamide
CID 42283584
5-(3-methyl-1,2-oxazol-5-yl)-N-(3-phenylpropyl)thiophene-2-sulfonamide
CID 20936205
4-bromo-N-ethyl-2,5-dimethyl-N-(3-methylphenyl)benzenesulfonamide
CID 66485793
5-chloro-N-ethyl-2-methoxy-4-methyl-N-(3-methylphenyl)benzenesulfonamide
CID 66485815
5-(3-methyl-1,2-oxazol-5-yl)-N-pyridin-2-ylthiophene-2-sulfonamide
CID 20936287
N-(2-chlorophenyl)-5-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 20936284

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide (CID 20936222) is N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide is CCN(c1cccc(C)c1)S(=O)(=O)c1ccc(-c2cc(C)no2)s1.
What is the InChIKey of N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide?
The InChIKey is GELJBFGLYUGPTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3S2/c1-4-19(14-7-5-6-12(2)10-14)24(20,21)17-9-8-16(23-17)15-11-13(3)18-22-15/h5-11H,4H2,1-3H3.
What are the key properties of N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide?
N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide has a molecular weight of 362.48 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 20936222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).