N-(2-cyclopropylpropan-2-yl)ethanesulfonamide

C8H17NO2S — CID 103697713

IUPACN-(2-cyclopropylpropan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(C)(C)C1CC1
InChIInChI=1S/C8H17NO2S/c1-4-12(10,11)9-8(2,3)7-5-6-7/h7,9H,4-6H2,1-3H3
InChIKeyDZTMABLJPUWXIH-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.11
Rot. Bonds4

About N-(2-cyclopropylpropan-2-yl)ethanesulfonamide

N-(2-cyclopropylpropan-2-yl)ethanesulfonamide (PubChem CID 103697713) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is N-(2-cyclopropylpropan-2-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-cyclopropylpropan-2-yl)ethanesulfonamide
PubChem CID103697713
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-(2-cyclopropylpropan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(C)(C)C1CC1
InChIInChI=1S/C8H17NO2S/c1-4-12(10,11)9-8(2,3)7-5-6-7/h7,9H,4-6H2,1-3H3
InChIKeyDZTMABLJPUWXIH-UHFFFAOYSA-N
XLogP1.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropan-2-yl)ethanesulfonamide?
The IUPAC name of N-(2-cyclopropylpropan-2-yl)ethanesulfonamide (CID 103697713) is N-(2-cyclopropylpropan-2-yl)ethanesulfonamide.
What is the SMILES notation for N-(2-cyclopropylpropan-2-yl)ethanesulfonamide?
The canonical SMILES for N-(2-cyclopropylpropan-2-yl)ethanesulfonamide is CCS(=O)(=O)NC(C)(C)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropan-2-yl)ethanesulfonamide?
The InChIKey is DZTMABLJPUWXIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2S/c1-4-12(10,11)9-8(2,3)7-5-6-7/h7,9H,4-6H2,1-3H3.
What are the key properties of N-(2-cyclopropylpropan-2-yl)ethanesulfonamide?
N-(2-cyclopropylpropan-2-yl)ethanesulfonamide has a molecular weight of 191.30 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropan-2-yl)ethanesulfonamide is sourced from PubChem (CID 103697713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).