2-cyclopentyl-5-phenyl-1,3-thiazole

C14H15NS — CID 174113230

IUPAC2-cyclopentyl-5-phenyl-1,3-thiazole
SMILESc1ccc(-c2cnc(C3CCCC3)s2)cc1
InChIInChI=1S/C14H15NS/c1-2-6-11(7-3-1)13-10-15-14(16-13)12-8-4-5-9-12/h1-3,6-7,10,12H,4-5,8-9H2
InChIKeyFDMPWNZVNLEBLC-UHFFFAOYSA-N
MW229.35 g/mol
LogP4.47
Rot. Bonds2

About 2-cyclopentyl-5-phenyl-1,3-thiazole

2-cyclopentyl-5-phenyl-1,3-thiazole (PubChem CID 174113230) has the molecular formula C14H15NS and a molecular weight of 229.35 g/mol. Its IUPAC name is 2-cyclopentyl-5-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-cyclopentyl-5-phenyl-1,3-thiazole
PubChem CID174113230
Molecular FormulaC14H15NS
Molecular Weight229.35 g/mol
Exact Mass229.09
IUPAC Name2-cyclopentyl-5-phenyl-1,3-thiazole
SMILESc1ccc(-c2cnc(C3CCCC3)s2)cc1
InChIInChI=1S/C14H15NS/c1-2-6-11(7-3-1)13-10-15-14(16-13)12-8-4-5-9-12/h1-3,6-7,10,12H,4-5,8-9H2
InChIKeyFDMPWNZVNLEBLC-UHFFFAOYSA-N
XLogP4.47
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-phenyl-1,3-thiazole?
The IUPAC name of 2-cyclopentyl-5-phenyl-1,3-thiazole (CID 174113230) is 2-cyclopentyl-5-phenyl-1,3-thiazole.
What is the SMILES notation for 2-cyclopentyl-5-phenyl-1,3-thiazole?
The canonical SMILES for 2-cyclopentyl-5-phenyl-1,3-thiazole is c1ccc(-c2cnc(C3CCCC3)s2)cc1.
What is the InChIKey of 2-cyclopentyl-5-phenyl-1,3-thiazole?
The InChIKey is FDMPWNZVNLEBLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NS/c1-2-6-11(7-3-1)13-10-15-14(16-13)12-8-4-5-9-12/h1-3,6-7,10,12H,4-5,8-9H2.
What are the key properties of 2-cyclopentyl-5-phenyl-1,3-thiazole?
2-cyclopentyl-5-phenyl-1,3-thiazole has a molecular weight of 229.35 g/mol, XLogP of 4.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-phenyl-1,3-thiazole is sourced from PubChem (CID 174113230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).