2-[(dimethylsulfamoylamino)methyl]oxolane

C7H16N2O3S — CID 3894576

IUPAC2-[(dimethylsulfamoylamino)methyl]oxolane
SMILESCN(C)S(=O)(=O)NCC1CCCO1
InChIInChI=1S/C7H16N2O3S/c1-9(2)13(10,11)8-6-7-4-3-5-12-7/h7-8H,3-6H2,1-2H3
InChIKeyRTMPRLXQTMTEIW-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.44
Rot. Bonds4

About 2-[(dimethylsulfamoylamino)methyl]oxolane

2-[(dimethylsulfamoylamino)methyl]oxolane (PubChem CID 3894576) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is 2-[(dimethylsulfamoylamino)methyl]oxolane.

Molecular Properties

Compound Name2-[(dimethylsulfamoylamino)methyl]oxolane
PubChem CID3894576
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC Name2-[(dimethylsulfamoylamino)methyl]oxolane
SMILESCN(C)S(=O)(=O)NCC1CCCO1
InChIInChI=1S/C7H16N2O3S/c1-9(2)13(10,11)8-6-7-4-3-5-12-7/h7-8H,3-6H2,1-2H3
InChIKeyRTMPRLXQTMTEIW-UHFFFAOYSA-N
XLogP-0.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(dimethylsulfamoylamino)methyl]oxolane?
The IUPAC name of 2-[(dimethylsulfamoylamino)methyl]oxolane (CID 3894576) is 2-[(dimethylsulfamoylamino)methyl]oxolane.
What is the SMILES notation for 2-[(dimethylsulfamoylamino)methyl]oxolane?
The canonical SMILES for 2-[(dimethylsulfamoylamino)methyl]oxolane is CN(C)S(=O)(=O)NCC1CCCO1.
What is the InChIKey of 2-[(dimethylsulfamoylamino)methyl]oxolane?
The InChIKey is RTMPRLXQTMTEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-9(2)13(10,11)8-6-7-4-3-5-12-7/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-[(dimethylsulfamoylamino)methyl]oxolane?
2-[(dimethylsulfamoylamino)methyl]oxolane has a molecular weight of 208.28 g/mol, XLogP of -0.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(dimethylsulfamoylamino)methyl]oxolane is sourced from PubChem (CID 3894576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).