2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide

C14H20F3N3OS — CID 172769578

IUPAC2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide
SMILESNC(=O)C(CCCN1CCCC[C@@H]1C(F)(F)F)c1nccs1
InChIInChI=1S/C14H20F3N3OS/c15-14(16,17)11-5-1-2-7-20(11)8-3-4-10(12(18)21)13-19-6-9-22-13/h6,9-11H,1-5,7-8H2,(H2,18,21)/t10?,11-/m1/s1
InChIKeyMTSLFWADKPRZKK-RRKGBCIJSA-N
MW335.40 g/mol
LogP2.91
Rot. Bonds6

About 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide

2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide (PubChem CID 172769578) has the molecular formula C14H20F3N3OS and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide
PubChem CID172769578
Molecular FormulaC14H20F3N3OS
Molecular Weight335.40 g/mol
Exact Mass335.13
IUPAC Name2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide
SMILESNC(=O)C(CCCN1CCCC[C@@H]1C(F)(F)F)c1nccs1
InChIInChI=1S/C14H20F3N3OS/c15-14(16,17)11-5-1-2-7-20(11)8-3-4-10(12(18)21)13-19-6-9-22-13/h6,9-11H,1-5,7-8H2,(H2,18,21)/t10?,11-/m1/s1
InChIKeyMTSLFWADKPRZKK-RRKGBCIJSA-N
XLogP2.91
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-oxo-3-[4-(1,3-thiazol-2-yl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)propanamide
CID 136521667
(2S)-2-[cyanomethyl-[(1R)-2,2,2-trifluoro-1-(1,3-thiazol-2-yl)ethyl]amino]-4-methylpentanamide
CID 87345783
3-(1,3-Thiazol-2-ylmethyl)-5-(trifluoromethyl)pyrrolidin-2-one
CID 177757175
1-[2-(1,3-Thiazol-2-yl)piperidin-1-yl]-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 72134044
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 75388046
1-[(2S)-2-(1,3-thiazol-2-yl)piperidin-1-yl]-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 95770149
1-[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]-3-(2,2,2-trifluoroethylamino)propan-1-one
CID 95770150
(3R)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 97241093
(3S)-N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 97241094
(4,4-Difluorocyclohexyl)-[3-(1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 110106766
N-[3-methyl-1-(1,3-thiazol-2-yl)butyl]-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110289669
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110716020

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide?
The IUPAC name of 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide (CID 172769578) is 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide?
The canonical SMILES for 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide is NC(=O)C(CCCN1CCCC[C@@H]1C(F)(F)F)c1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide?
The InChIKey is MTSLFWADKPRZKK-RRKGBCIJSA-N. The full InChI is InChI=1S/C14H20F3N3OS/c15-14(16,17)11-5-1-2-7-20(11)8-3-4-10(12(18)21)13-19-6-9-22-13/h6,9-11H,1-5,7-8H2,(H2,18,21)/t10?,11-/m1/s1.
What are the key properties of 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide?
2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide has a molecular weight of 335.40 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)-5-[(2R)-2-(trifluoromethyl)piperidin-1-yl]pentanamide is sourced from PubChem (CID 172769578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).