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

C11H13F3N2O2S — CID 111450807

IUPAC1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
SMILESO=C(NCc1nc(C(F)(F)F)cs1)C1(O)CCCC1
InChIInChI=1S/C11H13F3N2O2S/c12-11(13,14)7-6-19-8(16-7)5-15-9(17)10(18)3-1-2-4-10/h6,18H,1-5H2,(H,15,17)
InChIKeyNHAQKPBBJOVANR-UHFFFAOYSA-N
MW294.30 g/mol
LogP2.08
Rot. Bonds3

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

1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide (PubChem CID 111450807) has the molecular formula C11H13F3N2O2S and a molecular weight of 294.30 g/mol. Its IUPAC name is 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
PubChem CID111450807
Molecular FormulaC11H13F3N2O2S
Molecular Weight294.30 g/mol
Exact Mass294.06
IUPAC Name1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
SMILESO=C(NCc1nc(C(F)(F)F)cs1)C1(O)CCCC1
InChIInChI=1S/C11H13F3N2O2S/c12-11(13,14)7-6-19-8(16-7)5-15-9(17)10(18)3-1-2-4-10/h6,18H,1-5H2,(H,15,17)
InChIKeyNHAQKPBBJOVANR-UHFFFAOYSA-N
XLogP2.08
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 ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(dimethylamino)cyclopentyl]methyl]-4,4,4-trifluoro-3-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)butanamide
CID 56205231
2,2-difluoro-2-(1-hydroxycyclobutyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 109899934
4-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]thiane-4-carboxamide
CID 109905074
4-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]thiane-4-carboxamide
CID 109905220
3-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]thiolane-3-carboxamide
CID 109913762
3-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]thiolane-3-carboxamide
CID 109913844
3-hydroxy-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]propyl]thiolane-3-carboxamide
CID 109913896
2-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide
CID 110015923
1-[(1-Hydroxycyclopentyl)methyl]-3-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]urea
CID 111455772
1-hydroxy-N-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]cyclopentane-1-carboxamide
CID 111486712
1-[(1-Hydroxycyclopentyl)methyl]-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]urea
CID 111509246
2-(1-hydroxycyclohexyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 111540008

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide (CID 111450807) is 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide is O=C(NCc1nc(C(F)(F)F)cs1)C1(O)CCCC1.
What is the InChIKey of 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
The InChIKey is NHAQKPBBJOVANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2S/c12-11(13,14)7-6-19-8(16-7)5-15-9(17)10(18)3-1-2-4-10/h6,18H,1-5H2,(H,15,17).
What are the key properties of 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide?
1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide has a molecular weight of 294.30 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 111450807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).