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

C8H14N2O3S — CID 110646318

IUPACN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide
SMILESCc1noc(C)c1CCNS(C)(=O)=O
InChIInChI=1S/C8H14N2O3S/c1-6-8(7(2)13-10-6)4-5-9-14(3,11)12/h9H,4-5H2,1-3H3
InChIKeyJRFDRESZZQXDRW-UHFFFAOYSA-N
MW218.28 g/mol
LogP0.38
Rot. Bonds4

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

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide (PubChem CID 110646318) has the molecular formula C8H14N2O3S and a molecular weight of 218.28 g/mol. Its IUPAC name is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide
PubChem CID110646318
Molecular FormulaC8H14N2O3S
Molecular Weight218.28 g/mol
Exact Mass218.07
IUPAC NameN-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide
SMILESCc1noc(C)c1CCNS(C)(=O)=O
InChIInChI=1S/C8H14N2O3S/c1-6-8(7(2)13-10-6)4-5-9-14(3,11)12/h9H,4-5H2,1-3H3
InChIKeyJRFDRESZZQXDRW-UHFFFAOYSA-N
XLogP0.38
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110646333
5-chloro-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]thiophene-2-sulfonamide
CID 110646335
1-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(methylsulfonimidoyl)methanamine
CID 164644358
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-4-fluoro-2-methylbenzenesulfonamide
CID 110646326
N-[4-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]ethyl]phenyl]methanesulfonamide
CID 91644789
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methylpropan-1-amine
CID 23006357
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-methylsulfonylethanamine
CID 60920492
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-3-methylsulfonylpropanamide
CID 131925760
ethyl N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]carbamate
CID 110646305
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]butan-2-amine
CID 115718218
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-propanoylbenzenesulfonamide
CID 71912550
4-cyclopentyloxy-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzenesulfonamide
CID 110646346

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide (CID 110646318) is N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide is Cc1noc(C)c1CCNS(C)(=O)=O.
What is the InChIKey of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide?
The InChIKey is JRFDRESZZQXDRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3S/c1-6-8(7(2)13-10-6)4-5-9-14(3,11)12/h9H,4-5H2,1-3H3.
What are the key properties of N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide?
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide has a molecular weight of 218.28 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]methanesulfonamide is sourced from PubChem (CID 110646318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).