1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride

C10H16ClF3N2OS — CID 119267648

IUPAC1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride
SMILESCl.O=C(C1CSCN1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C10H15F3N2OS.ClH/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8;/h7-8,14H,1-6H2;1H
InChIKeyCUVSJOHNNFVCBD-UHFFFAOYSA-N
MW304.77 g/mol
LogP1.87
Rot. Bonds1

About 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride

1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride (PubChem CID 119267648) has the molecular formula C10H16ClF3N2OS and a molecular weight of 304.77 g/mol. Its IUPAC name is 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride.

Molecular Properties

Compound Name1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride
PubChem CID119267648
Molecular FormulaC10H16ClF3N2OS
Molecular Weight304.77 g/mol
Exact Mass304.06
IUPAC Name1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride
SMILESCl.O=C(C1CSCN1)N1CCCC(C(F)(F)F)C1
InChIInChI=1S/C10H15F3N2OS.ClH/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8;/h7-8,14H,1-6H2;1H
InChIKeyCUVSJOHNNFVCBD-UHFFFAOYSA-N
XLogP1.87
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.77
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methyl-N-(3-methylbutyl)-4-propanoyl-1-thia-4,8-diazaspiro[4.5]decane-3-carboxamide
CID 20919142
3,3-di(propan-2-yl)-6-(2,2,2-trifluoroethylamino)-6,7,8,8a-tetrahydro-2H-[1,3]thiazolo[3,2-a]pyridin-5-one
CID 160361880
N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazolidine-4-carboxamide
CID 43711820
N-[4-(trifluoromethyl)cyclohexyl]-1,3-thiazolidine-4-carboxamide
CID 43712690
N-[2-(trifluoromethyl)cyclohexyl]-1,3-thiazolidine-4-carboxamide
CID 43712749
3-propanoyl-N-[3-(trifluoromethyl)cyclohexyl]-1,3-thiazolidine-4-carboxamide
CID 53554537
3-propanoyl-N-[2-(trifluoromethyl)cyclohexyl]-1,3-thiazolidine-4-carboxamide
CID 53583346
N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 54870138
N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide
CID 54871878
1,3-Thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 54936762
(2S)-2-amino-4-methylsulfanyl-1-[3-(trifluoromethyl)piperidin-1-yl]butan-1-one
CID 61179033
1,3-Thiazolidin-4-yl-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 61260157

Frequently Asked Questions

What is the IUPAC name of 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride?
The IUPAC name of 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride (CID 119267648) is 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride.
What is the SMILES notation for 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride?
The canonical SMILES for 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride is Cl.O=C(C1CSCN1)N1CCCC(C(F)(F)F)C1.
What is the InChIKey of 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride?
The InChIKey is CUVSJOHNNFVCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2OS.ClH/c11-10(12,13)7-2-1-3-15(4-7)9(16)8-5-17-6-14-8;/h7-8,14H,1-6H2;1H.
What are the key properties of 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride?
1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride has a molecular weight of 304.77 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-thiazolidin-4-yl-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride is sourced from PubChem (CID 119267648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).