2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide

C12H15F3N2O2S — CID 111540010

IUPAC2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
SMILESO=C(CC1(O)CCCC1)NCc1nc(C(F)(F)F)cs1
InChIInChI=1S/C12H15F3N2O2S/c13-12(14,15)8-7-20-10(17-8)6-16-9(18)5-11(19)3-1-2-4-11/h7,19H,1-6H2,(H,16,18)
InChIKeySOHBXRFHIDJQBS-UHFFFAOYSA-N
MW308.33 g/mol
LogP2.47
Rot. Bonds4

About 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide

2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide (PubChem CID 111540010) has the molecular formula C12H15F3N2O2S and a molecular weight of 308.33 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
PubChem CID111540010
Molecular FormulaC12H15F3N2O2S
Molecular Weight308.33 g/mol
Exact Mass308.08
IUPAC Name2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
SMILESO=C(CC1(O)CCCC1)NCc1nc(C(F)(F)F)cs1
InChIInChI=1S/C12H15F3N2O2S/c13-12(14,15)8-7-20-10(17-8)6-16-9(18)5-11(19)3-1-2-4-11/h7,19H,1-6H2,(H,16,18)
InChIKeySOHBXRFHIDJQBS-UHFFFAOYSA-N
XLogP2.47
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 ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide?
The IUPAC name of 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide (CID 111540010) is 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide is O=C(CC1(O)CCCC1)NCc1nc(C(F)(F)F)cs1.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide?
The InChIKey is SOHBXRFHIDJQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O2S/c13-12(14,15)8-7-20-10(17-8)6-16-9(18)5-11(19)3-1-2-4-11/h7,19H,1-6H2,(H,16,18).
What are the key properties of 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide?
2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide has a molecular weight of 308.33 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide is sourced from PubChem (CID 111540010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).