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

C11H18N2O3S — CID 114545207

IUPAC3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NC1CCC(C)C1
InChIInChI=1S/C11H18N2O3S/c1-7-4-5-10(6-7)13-17(14,15)11-8(2)12-16-9(11)3/h7,10,13H,4-6H2,1-3H3
InChIKeyQVKMYESGRIOZSE-UHFFFAOYSA-N
MW258.34 g/mol
LogP1.76
Rot. Bonds3

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

3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide (PubChem CID 114545207) has the molecular formula C11H18N2O3S and a molecular weight of 258.34 g/mol. Its IUPAC name is 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide
PubChem CID114545207
Molecular FormulaC11H18N2O3S
Molecular Weight258.34 g/mol
Exact Mass258.10
IUPAC Name3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NC1CCC(C)C1
InChIInChI=1S/C11H18N2O3S/c1-7-4-5-10(6-7)13-17(14,15)11-8(2)12-16-9(11)3/h7,10,13H,4-6H2,1-3H3
InChIKeyQVKMYESGRIOZSE-UHFFFAOYSA-N
XLogP1.76
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 4750113
3,5-Dimethylisoxazole-4-sulfonamide
CID 4962303
1-((3,5-Dimethylisoxazol-4-yl)sulfonyl)piperidine-4-carboxamide
CID 2812753
N-[2-(cyclohexen-1-yl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 8470221
3,5-dimethyl-N-[2-(2-methylcyclohexyl)oxyethyl]-1,2-oxazole-4-sulfonamide
CID 45891513
(3R*,4S*)-1-[(3,5-dimethylisoxazol-4-yl)sulfonyl]-4-propylpyrrolidin-3-amine
CID 72839592
3,5-dimethyl-N-[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobuten-1-yl]-1,2-oxazole-4-sulfonamide
CID 118737851
3,5-dimethyl-N-propan-2-yl-1,2-oxazole-4-sulfonamide
CID 6624547
N-[(1-Aminocyclohexyl)methyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 43598180
1-[(Dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidin-4-amine hydrochloride
CID 72716260
N-cycloheptyl-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 6621710
3,5-Dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-1,2-oxazole
CID 6621738

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide (CID 114545207) is 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide is Cc1noc(C)c1S(=O)(=O)NC1CCC(C)C1.
What is the InChIKey of 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide?
The InChIKey is QVKMYESGRIOZSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-7-4-5-10(6-7)13-17(14,15)11-8(2)12-16-9(11)3/h7,10,13H,4-6H2,1-3H3.
What are the key properties of 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide?
3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide has a molecular weight of 258.34 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(3-methylcyclopentyl)-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 114545207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).