N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

C10H18N2O4S — CID 115650821

IUPACN-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
SMILESCCN(CCCO)S(=O)(=O)Cc1cc(C)on1
InChIInChI=1S/C10H18N2O4S/c1-3-12(5-4-6-13)17(14,15)8-10-7-9(2)16-11-10/h7,13H,3-6,8H2,1-2H3
InChIKeyCWFPBZIRNNXIAZ-UHFFFAOYSA-N
MW262.33 g/mol
LogP0.52
Rot. Bonds7

About N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide (PubChem CID 115650821) has the molecular formula C10H18N2O4S and a molecular weight of 262.33 g/mol. Its IUPAC name is N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
PubChem CID115650821
Molecular FormulaC10H18N2O4S
Molecular Weight262.33 g/mol
Exact Mass262.10
IUPAC NameN-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
SMILESCCN(CCCO)S(=O)(=O)Cc1cc(C)on1
InChIInChI=1S/C10H18N2O4S/c1-3-12(5-4-6-13)17(14,15)8-10-7-9(2)16-11-10/h7,13H,3-6,8H2,1-2H3
InChIKeyCWFPBZIRNNXIAZ-UHFFFAOYSA-N
XLogP0.52
TPSA83.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(dimethylamino)ethyl-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]amino]acetic acid
CID 107424559
N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608211
N-(6-hydroxyhexyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 103918339
N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43258971
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]ethanesulfonamide
CID 61356856
N-(3-aminophenyl)-1-(5-methyl-1,2-oxazol-3-yl)-N-propylmethanesulfonamide
CID 63230035
2-[cyclopentyl-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]amino]acetic acid
CID 60827962
2-[4-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperazin-1-yl]ethanol
CID 43501424
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)-N-pyrrolidin-3-ylmethanesulfonamide
CID 63297663
N-[(2R)-1-hydroxypropan-2-yl]-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 64722552
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)-N-(2-piperazin-1-ylethyl)methanesulfonamide
CID 63265679
(2S)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]propanoic acid
CID 28788047

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The IUPAC name of N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide (CID 115650821) is N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The canonical SMILES for N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide is CCN(CCCO)S(=O)(=O)Cc1cc(C)on1.
What is the InChIKey of N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The InChIKey is CWFPBZIRNNXIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O4S/c1-3-12(5-4-6-13)17(14,15)8-10-7-9(2)16-11-10/h7,13H,3-6,8H2,1-2H3.
What are the key properties of N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide has a molecular weight of 262.33 g/mol, XLogP of 0.52, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide is sourced from PubChem (CID 115650821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).