5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole

C17H21NOS — CID 173063582

IUPAC5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole
SMILESCC(Cc1cncs1)Oc1ccccc1C1CCCC1
InChIInChI=1S/C17H21NOS/c1-13(10-15-11-18-12-20-15)19-17-9-5-4-8-16(17)14-6-2-3-7-14/h4-5,8-9,11-14H,2-3,6-7,10H2,1H3
InChIKeyUCHZNWRAMRJBGY-UHFFFAOYSA-N
MW287.43 g/mol
LogP4.81
Rot. Bonds5

About 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole

5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole (PubChem CID 173063582) has the molecular formula C17H21NOS and a molecular weight of 287.43 g/mol. Its IUPAC name is 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole.

Molecular Properties

Compound Name5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole
PubChem CID173063582
Molecular FormulaC17H21NOS
Molecular Weight287.43 g/mol
Exact Mass287.13
IUPAC Name5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole
SMILESCC(Cc1cncs1)Oc1ccccc1C1CCCC1
InChIInChI=1S/C17H21NOS/c1-13(10-15-11-18-12-20-15)19-17-9-5-4-8-16(17)14-6-2-3-7-14/h4-5,8-9,11-14H,2-3,6-7,10H2,1H3
InChIKeyUCHZNWRAMRJBGY-UHFFFAOYSA-N
XLogP4.81
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole?
The IUPAC name of 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole (CID 173063582) is 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole.
What is the SMILES notation for 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole?
The canonical SMILES for 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole is CC(Cc1cncs1)Oc1ccccc1C1CCCC1.
What is the InChIKey of 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole?
The InChIKey is UCHZNWRAMRJBGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NOS/c1-13(10-15-11-18-12-20-15)19-17-9-5-4-8-16(17)14-6-2-3-7-14/h4-5,8-9,11-14H,2-3,6-7,10H2,1H3.
What are the key properties of 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole?
5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole has a molecular weight of 287.43 g/mol, XLogP of 4.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-cyclopentylphenoxy)propyl]-1,3-thiazole is sourced from PubChem (CID 173063582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).