2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide

C12H15F3N2O2S — CID 110014818

IUPAC2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
SMILESO=C(NCCc1nc(C(F)(F)F)cs1)C1CCCC1O
InChIInChI=1S/C12H15F3N2O2S/c13-12(14,15)9-6-20-10(17-9)4-5-16-11(19)7-2-1-3-8(7)18/h6-8,18H,1-5H2,(H,16,19)
InChIKeyOEGOAQSJYMOPRH-UHFFFAOYSA-N
MW308.33 g/mol
LogP1.98
Rot. Bonds4

About 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide

2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide (PubChem CID 110014818) has the molecular formula C12H15F3N2O2S and a molecular weight of 308.33 g/mol. Its IUPAC name is 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
PubChem CID110014818
Molecular FormulaC12H15F3N2O2S
Molecular Weight308.33 g/mol
Exact Mass308.08
IUPAC Name2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
SMILESO=C(NCCc1nc(C(F)(F)F)cs1)C1CCCC1O
InChIInChI=1S/C12H15F3N2O2S/c13-12(14,15)9-6-20-10(17-9)4-5-16-11(19)7-2-1-3-8(7)18/h6-8,18H,1-5H2,(H,16,19)
InChIKeyOEGOAQSJYMOPRH-UHFFFAOYSA-N
XLogP1.98
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-3-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]butanamide
CID 71909517
N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentanecarboxamide
CID 71993371
(3R)-3-cyclopropyl-3-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]butanamide
CID 97086417
(3S)-3-cyclopropyl-3-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]butanamide
CID 97086418
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[3-(4-methyl-1,3-thiazol-2-yl)propyl]acetamide
CID 109898738
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[4-(4-methyl-1,3-thiazol-2-yl)butyl]acetamide
CID 109898745
2-hydroxy-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]cyclopentane-1-carboxamide
CID 110014857
2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
CID 110015923
(2-Hydroxycyclopentyl)-[3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone
CID 110016470
1-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
CID 111486712
2-(1-hydroxycyclohexyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 111540008
2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 111540010

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide (CID 110014818) is 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide is O=C(NCCc1nc(C(F)(F)F)cs1)C1CCCC1O.
What is the InChIKey of 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide?
The InChIKey is OEGOAQSJYMOPRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O2S/c13-12(14,15)9-6-20-10(17-9)4-5-16-11(19)7-2-1-3-8(7)18/h6-8,18H,1-5H2,(H,16,19).
What are the key properties of 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide?
2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide has a molecular weight of 308.33 g/mol, XLogP of 1.98, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110014818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).