N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide

C10H21NO4S — CID 63247520

IUPACN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(CCO)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C10H21NO4S/c1-9(2)11(5-6-12)16(13,14)8-10-4-3-7-15-10/h9-10,12H,3-8H2,1-2H3
InChIKeySHNKLYIXYLXXFL-UHFFFAOYSA-N
MW251.35 g/mol
LogP0.20
Rot. Bonds6

About N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide

N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide (PubChem CID 63247520) has the molecular formula C10H21NO4S and a molecular weight of 251.35 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide
PubChem CID63247520
Molecular FormulaC10H21NO4S
Molecular Weight251.35 g/mol
Exact Mass251.12
IUPAC NameN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(CCO)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C10H21NO4S/c1-9(2)11(5-6-12)16(13,14)8-10-4-3-7-15-10/h9-10,12H,3-8H2,1-2H3
InChIKeySHNKLYIXYLXXFL-UHFFFAOYSA-N
XLogP0.20
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-N-(2-hydroxyethyl)-N-propan-2-ylmethanesulfonamide
CID 54947469
N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide
CID 115754603
N-(1-chloropropan-2-yl)-N-methyl-1-(oxolan-2-yl)methanesulfonamide
CID 104556477
N-(2-aminophenyl)-N-(2-hydroxyethyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63246467
(2R)-2-(methylsulfonylmethyl)oxolane
CID 68993549
N-(3-bromopropyl)-N-methyl-1-(oxolan-2-yl)methanesulfonamide
CID 106441751
(2R)-2-(oxolan-2-ylmethylsulfonylamino)propanoic acid
CID 78927442
N-(1-aminopropan-2-yl)-N-methyl-1-(oxan-2-yl)methanesulfonamide
CID 119982374
2-(oxan-2-ylmethylsulfonyl)ethanol
CID 71857024
2-[oxolan-2-ylmethylsulfonyl(propyl)amino]ethanethioamide
CID 55173354
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 79387072
2-methyl-3-(oxolan-2-ylmethylsulfonyl)butanoic acid
CID 106493648

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide (CID 63247520) is N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide is CC(C)N(CCO)S(=O)(=O)CC1CCCO1.
What is the InChIKey of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide?
The InChIKey is SHNKLYIXYLXXFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4S/c1-9(2)11(5-6-12)16(13,14)8-10-4-3-7-15-10/h9-10,12H,3-8H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide?
N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide has a molecular weight of 251.35 g/mol, XLogP of 0.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide is sourced from PubChem (CID 63247520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).