N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide

C10H18N2O2S2 — CID 71997183

IUPACN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1ncc(CC)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-7-16(13,14)12-6-5-10-11-8-9(4-2)15-10/h8,12H,3-7H2,1-2H3
InChIKeyRHVFZRDPWHYFDG-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.58
Rot. Bonds7

About N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide

N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide (PubChem CID 71997183) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide
PubChem CID71997183
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1ncc(CC)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-7-16(13,14)12-6-5-10-11-8-9(4-2)15-10/h8,12H,3-7H2,1-2H3
InChIKeyRHVFZRDPWHYFDG-UHFFFAOYSA-N
XLogP1.58
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide?
The IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide (CID 71997183) is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide.
What is the SMILES notation for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide?
The canonical SMILES for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide is CCCS(=O)(=O)NCCc1ncc(CC)s1.
What is the InChIKey of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide?
The InChIKey is RHVFZRDPWHYFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-3-7-16(13,14)12-6-5-10-11-8-9(4-2)15-10/h8,12H,3-7H2,1-2H3.
What are the key properties of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide?
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide has a molecular weight of 262.40 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propane-1-sulfonamide is sourced from PubChem (CID 71997183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).