4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide

C18H24N2O4S — CID 110646346

IUPAC4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide
SMILESCc1noc(C)c1CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C18H24N2O4S/c1-13-18(14(2)24-20-13)11-12-19-25(21,22)17-9-7-16(8-10-17)23-15-5-3-4-6-15/h7-10,15,19H,3-6,11-12H2,1-2H3
InChIKeyUQRSQQSBQWNVSY-UHFFFAOYSA-N
MW364.47 g/mol
LogP3.13
Rot. Bonds7

About 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide

4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide (PubChem CID 110646346) has the molecular formula C18H24N2O4S and a molecular weight of 364.47 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide
PubChem CID110646346
Molecular FormulaC18H24N2O4S
Molecular Weight364.47 g/mol
Exact Mass364.15
IUPAC Name4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide
SMILESCc1noc(C)c1CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C18H24N2O4S/c1-13-18(14(2)24-20-13)11-12-19-25(21,22)17-9-7-16(8-10-17)23-15-5-3-4-6-15/h7-10,15,19H,3-6,11-12H2,1-2H3
InChIKeyUQRSQQSBQWNVSY-UHFFFAOYSA-N
XLogP3.13
TPSA81.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-cyclopentyloxy-N-[2-(1H-pyrazol-5-yl)ethyl]benzenesulfonamide
CID 110731903
4-cyclopentyloxy-N-[2-(2-hydroxyphenyl)ethyl]benzenesulfonamide
CID 110605334
4-cyclopentyloxy-N-[2-[2-(methylamino)-1,3-thiazol-4-yl]ethyl]benzenesulfonamide
CID 110397987
4-cyclopentyloxy-N-[3-(dimethylamino)propyl]benzenesulfonamide
CID 110408180
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3,4-dihydro-2H-chromene-6-sulfonamide
CID 136520086
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide
CID 110646318
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110646333
4-cyclopentyloxy-N-[3-(2,2,2-trifluoroethoxy)propyl]benzenesulfonamide
CID 87032494
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(3,5-dimethylphenyl)benzenesulfonamide
CID 89484262
5-chloro-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110646335
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-propanoylbenzenesulfonamide
CID 71912550
N-[2-[(4-cyclopentyloxyphenyl)sulfonylamino]ethyl]-N-(2-methoxyethyl)acetamide
CID 113053247

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide?
The IUPAC name of 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide (CID 110646346) is 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide is Cc1noc(C)c1CCNS(=O)(=O)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide?
The InChIKey is UQRSQQSBQWNVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4S/c1-13-18(14(2)24-20-13)11-12-19-25(21,22)17-9-7-16(8-10-17)23-15-5-3-4-6-15/h7-10,15,19H,3-6,11-12H2,1-2H3.
What are the key properties of 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide?
4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide has a molecular weight of 364.47 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110646346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).