N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide

C10H19NO4S — CID 115754603

IUPACN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide
SMILESC=CCN(CCO)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C10H19NO4S/c1-2-5-11(6-7-12)16(13,14)9-10-4-3-8-15-10/h2,10,12H,1,3-9H2
InChIKeyQIXMNMKGVMKTNL-UHFFFAOYSA-N
MW249.33 g/mol
LogP-0.02
Rot. Bonds7

About N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide

N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide (PubChem CID 115754603) has the molecular formula C10H19NO4S and a molecular weight of 249.33 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide
PubChem CID115754603
Molecular FormulaC10H19NO4S
Molecular Weight249.33 g/mol
Exact Mass249.10
IUPAC NameN-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide
SMILESC=CCN(CCO)S(=O)(=O)CC1CCCO1
InChIInChI=1S/C10H19NO4S/c1-2-5-11(6-7-12)16(13,14)9-10-4-3-8-15-10/h2,10,12H,1,3-9H2
InChIKeyQIXMNMKGVMKTNL-UHFFFAOYSA-N
XLogP-0.02
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-propan-2-ylmethanesulfonamide
CID 63247520
2-[oxolan-2-ylmethylsulfonyl(propyl)amino]ethanethioamide
CID 55173354
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 79387072
N-(2-aminophenyl)-N-(2-hydroxyethyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63246467
2-(oxan-2-ylmethylsulfonyl)ethanol
CID 71857024
N-(3-bromopropyl)-N-methyl-1-(oxolan-2-yl)methanesulfonamide
CID 106441751
(2R)-2-(methylsulfonylmethyl)oxolane
CID 68993549
N-(3-hydroxypropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 63247384
3-[[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-prop-2-enylamino]propanoic acid
CID 82327265
N-(3-aminopropyl)-N-cyclopentyl-1-(oxolan-2-yl)methanesulfonamide
CID 63246646
1,1-difluoro-N-(2-hydroxyethyl)-N-prop-2-enylmethanesulfonamide
CID 115754602
N-(1-chloropropan-2-yl)-N-methyl-1-(oxolan-2-yl)methanesulfonamide
CID 104556477

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide (CID 115754603) is N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide is C=CCN(CCO)S(=O)(=O)CC1CCCO1.
What is the InChIKey of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide?
The InChIKey is QIXMNMKGVMKTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4S/c1-2-5-11(6-7-12)16(13,14)9-10-4-3-8-15-10/h2,10,12H,1,3-9H2.
What are the key properties of N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide?
N-(2-hydroxyethyl)-1-(oxolan-2-yl)-N-prop-2-enylmethanesulfonamide has a molecular weight of 249.33 g/mol, XLogP of -0.02, 7 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-prop-2-enylmethanesulfonamide is sourced from PubChem (CID 115754603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).