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

C11H13F3N2O2S — CID 110015923

IUPAC2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
SMILESO=C(NCc1nc(C(F)(F)F)cs1)C1CCCC1O
InChIInChI=1S/C11H13F3N2O2S/c12-11(13,14)8-5-19-9(16-8)4-15-10(18)6-2-1-3-7(6)17/h5-7,17H,1-4H2,(H,15,18)
InChIKeyLCWNJEXPZFAHBU-UHFFFAOYSA-N
MW294.30 g/mol
LogP1.94
Rot. Bonds3

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

2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide (PubChem CID 110015923) has the molecular formula C11H13F3N2O2S and a molecular weight of 294.30 g/mol. Its IUPAC name is 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
PubChem CID110015923
Molecular FormulaC11H13F3N2O2S
Molecular Weight294.30 g/mol
Exact Mass294.06
IUPAC Name2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
SMILESO=C(NCc1nc(C(F)(F)F)cs1)C1CCCC1O
InChIInChI=1S/C11H13F3N2O2S/c12-11(13,14)8-5-19-9(16-8)4-15-10(18)6-2-1-3-7(6)17/h5-7,17H,1-4H2,(H,15,18)
InChIKeyLCWNJEXPZFAHBU-UHFFFAOYSA-N
XLogP1.94
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.30
LogP ≤ 51.94
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
2-(oxolan-2-yl)-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]acetamide
CID 71985930
2-[(2S)-oxolan-2-yl]-N-[(1S)-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]acetamide
CID 95906733
2-[(2S)-oxolan-2-yl]-N-[(1R)-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]acetamide
CID 95906734
2-[(2R)-oxolan-2-yl]-N-[(1S)-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]acetamide
CID 95906735
2-[(2R)-oxolan-2-yl]-N-[(1R)-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]acetamide
CID 95906736
(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
1-[(2-Hydroxycyclopentyl)methyl]-1-methyl-3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]urea
CID 109398697
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 109898764
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 109899934
2-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
CID 110014818

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide (CID 110015923) is 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide is O=C(NCc1nc(C(F)(F)F)cs1)C1CCCC1O.
What is the InChIKey of 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The InChIKey is LCWNJEXPZFAHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2S/c12-11(13,14)8-5-19-9(16-8)4-15-10(18)6-2-1-3-7(6)17/h5-7,17H,1-4H2,(H,15,18).
What are the key properties of 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide has a molecular weight of 294.30 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110015923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).