2-(3-thiophen-2-ylpropyl)-1,3-thiazole

C10H11NS2 — CID 141496467

IUPAC2-(3-thiophen-2-ylpropyl)-1,3-thiazole
SMILESc1csc(CCCc2nccs2)c1
InChIInChI=1S/C10H11NS2/c1(3-9-4-2-7-12-9)5-10-11-6-8-13-10/h2,4,6-8H,1,3,5H2
InChIKeyDAIDGLZJQGNHRD-UHFFFAOYSA-N
MW209.34 g/mol
LogP3.38
Rot. Bonds4

About 2-(3-thiophen-2-ylpropyl)-1,3-thiazole

2-(3-thiophen-2-ylpropyl)-1,3-thiazole (PubChem CID 141496467) has the molecular formula C10H11NS2 and a molecular weight of 209.34 g/mol. Its IUPAC name is 2-(3-thiophen-2-ylpropyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(3-thiophen-2-ylpropyl)-1,3-thiazole
PubChem CID141496467
Molecular FormulaC10H11NS2
Molecular Weight209.34 g/mol
Exact Mass209.03
IUPAC Name2-(3-thiophen-2-ylpropyl)-1,3-thiazole
SMILESc1csc(CCCc2nccs2)c1
InChIInChI=1S/C10H11NS2/c1(3-9-4-2-7-12-9)5-10-11-6-8-13-10/h2,4,6-8H,1,3,5H2
InChIKeyDAIDGLZJQGNHRD-UHFFFAOYSA-N
XLogP3.38
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-thiazol-2-yl)-5-thiophen-2-ylpentan-2-amine
CID 105169170
2-(5-chloropentyl)thiophene
CID 4912993
N-(2-thiophen-2-ylethyl)-1,3-thiazol-2-amine
CID 29276059
3-thiophen-2-ylpropan-1-ol
CID 13109866
2-(4-fluorobutyl)thiophene
CID 67851736
10-thiophen-2-yldecan-1-ol
CID 22992199
ethane;2-pentylthiophene
CID 143883800
2-butylthiophene;methanamine
CID 143080300
20-thiophen-2-ylicosane-1-thiol
CID 15444594
10-thiophen-2-yldecan-1-amine
CID 22115195
2-(thiophen-2-ylmethylsulfanyl)-1,3-thiazole
CID 130628845
N-methyl-N-(1,3-thiazol-2-yl)-3-thiophen-2-ylpropanamide
CID 110723376

Frequently Asked Questions

What is the IUPAC name of 2-(3-thiophen-2-ylpropyl)-1,3-thiazole?
The IUPAC name of 2-(3-thiophen-2-ylpropyl)-1,3-thiazole (CID 141496467) is 2-(3-thiophen-2-ylpropyl)-1,3-thiazole.
What is the SMILES notation for 2-(3-thiophen-2-ylpropyl)-1,3-thiazole?
The canonical SMILES for 2-(3-thiophen-2-ylpropyl)-1,3-thiazole is c1csc(CCCc2nccs2)c1.
What is the InChIKey of 2-(3-thiophen-2-ylpropyl)-1,3-thiazole?
The InChIKey is DAIDGLZJQGNHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NS2/c1(3-9-4-2-7-12-9)5-10-11-6-8-13-10/h2,4,6-8H,1,3,5H2.
What are the key properties of 2-(3-thiophen-2-ylpropyl)-1,3-thiazole?
2-(3-thiophen-2-ylpropyl)-1,3-thiazole has a molecular weight of 209.34 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-thiophen-2-ylpropyl)-1,3-thiazole is sourced from PubChem (CID 141496467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).