1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone

C10H11F3N2OS — CID 63038430

IUPAC1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone
SMILESO=C(c1cscn1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C10H11F3N2OS/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8/h5-7H,1-4H2
InChIKeyBOICOMVHEMMONH-UHFFFAOYSA-N
MW264.27 g/mol
LogP2.56
Rot. Bonds1

About 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone

1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone (PubChem CID 63038430) has the molecular formula C10H11F3N2OS and a molecular weight of 264.27 g/mol. Its IUPAC name is 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone
PubChem CID63038430
Molecular FormulaC10H11F3N2OS
Molecular Weight264.27 g/mol
Exact Mass264.05
IUPAC Name1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone
SMILESO=C(c1cscn1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C10H11F3N2OS/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8/h5-7H,1-4H2
InChIKeyBOICOMVHEMMONH-UHFFFAOYSA-N
XLogP2.56
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone with MolForge

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

Launch Full Analysis

Related Compounds

N-ethyl-1-(1,3-thiazol-4-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 71988838
[(4S)-4-methylazepan-1-yl]-(1,3-thiazol-4-yl)methanone
CID 96462663
2-methyl-N-[3-[(3S)-3-methylpiperidin-1-yl]propyl]-1,3-thiazole-4-carboxamide
CID 52317008
N-piperidin-4-yl-N-propyl-1,3-thiazole-4-carboxamide
CID 63022016
N-cyclohexyl-N-(3,3,3-trifluoropropyl)-1,3-thiazole-4-carboxamide
CID 71858990
N-[(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-yl]-1,3-thiazole-4-carboxamide
CID 95905650
N-[(3S)-oxan-3-yl]-N-(2,2,2-trifluoroethyl)-1,3-thiazole-4-carboxamide
CID 97051833
(3S)-3-methyl-3-propyl-4-(1,3-thiazole-4-carbonyl)piperazin-2-one
CID 99829095
[2-(Difluoromethyl)morpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 121565148
(3,3-Difluoropyrrolidin-1-yl)-(1,3-thiazol-4-yl)methanone
CID 130685234
4-Cyclopropyl-1-(1,3-thiazole-4-carbonyl)piperidine
CID 137967224
2-methyl-N-(3-pyrrolidin-1-ylpropyl)-N-[(3S)-1-(1,3-thiazole-4-carbonyl)piperidin-3-yl]propanamide
CID 164635642

Frequently Asked Questions

What is the IUPAC name of 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone?
The IUPAC name of 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone (CID 63038430) is 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone.
What is the SMILES notation for 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone?
The canonical SMILES for 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone is O=C(c1cscn1)N1CCCC(C(F)(F)F)C1.
What is the InChIKey of 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone?
The InChIKey is BOICOMVHEMMONH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2OS/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8/h5-7H,1-4H2.
What are the key properties of 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone?
1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone has a molecular weight of 264.27 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-thiazol-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 63038430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).