N-(thiolan-3-yl)propane-2-sulfonamide

C7H15NO2S2 — CID 103698011

IUPACN-(thiolan-3-yl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1CCSC1
InChIInChI=1S/C7H15NO2S2/c1-6(2)12(9,10)8-7-3-4-11-5-7/h6-8H,3-5H2,1-2H3
InChIKeyDJFIGYUOFUCOEG-UHFFFAOYSA-N
MW209.34 g/mol
LogP0.82
Rot. Bonds3

About N-(thiolan-3-yl)propane-2-sulfonamide

N-(thiolan-3-yl)propane-2-sulfonamide (PubChem CID 103698011) has the molecular formula C7H15NO2S2 and a molecular weight of 209.34 g/mol. Its IUPAC name is N-(thiolan-3-yl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(thiolan-3-yl)propane-2-sulfonamide
PubChem CID103698011
Molecular FormulaC7H15NO2S2
Molecular Weight209.34 g/mol
Exact Mass209.05
IUPAC NameN-(thiolan-3-yl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1CCSC1
InChIInChI=1S/C7H15NO2S2/c1-6(2)12(9,10)8-7-3-4-11-5-7/h6-8H,3-5H2,1-2H3
InChIKeyDJFIGYUOFUCOEG-UHFFFAOYSA-N
XLogP0.82
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(propan-2-ylamino)-N-(thiolan-3-yl)propane-1-sulfonamide
CID 103063616
N-cyclodecylpropane-2-sulfonamide
CID 131977128
1-(ethylamino)-N-(thian-4-yl)propane-2-sulfonamide
CID 106084518
4-(methylamino)-N-(thiolan-3-yl)butane-1-sulfonamide
CID 106086184
3-amino-N-(thiolan-3-yl)butanamide
CID 103811759
N-(3-bicyclo[3.1.0]hexanyl)propane-2-sulfonamide
CID 130974894
2-cyclopropyl-N-(thiolan-3-yl)propanamide
CID 127000268
N-(1-ethylsulfonylpropan-2-yl)thian-4-amine
CID 115626125
4-acetyl-N-(thiolan-3-yl)benzenesulfonamide
CID 103697977
N-[(1R)-1-cyclopentylethyl]thiolan-3-amine
CID 81394776
N-(3,4-dimethylcyclohexyl)propane-2-sulfonamide
CID 64749002
thian-3-ylsulfamic acid
CID 14594130

Frequently Asked Questions

What is the IUPAC name of N-(thiolan-3-yl)propane-2-sulfonamide?
The IUPAC name of N-(thiolan-3-yl)propane-2-sulfonamide (CID 103698011) is N-(thiolan-3-yl)propane-2-sulfonamide.
What is the SMILES notation for N-(thiolan-3-yl)propane-2-sulfonamide?
The canonical SMILES for N-(thiolan-3-yl)propane-2-sulfonamide is CC(C)S(=O)(=O)NC1CCSC1.
What is the InChIKey of N-(thiolan-3-yl)propane-2-sulfonamide?
The InChIKey is DJFIGYUOFUCOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S2/c1-6(2)12(9,10)8-7-3-4-11-5-7/h6-8H,3-5H2,1-2H3.
What are the key properties of N-(thiolan-3-yl)propane-2-sulfonamide?
N-(thiolan-3-yl)propane-2-sulfonamide has a molecular weight of 209.34 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiolan-3-yl)propane-2-sulfonamide is sourced from PubChem (CID 103698011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).