N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride

C10H13ClF3N3OS2 — CID 119340397

IUPACN-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCN(Cc1nc(C(F)(F)F)cs1)C(=O)C1CSCN1.Cl
InChIInChI=1S/C10H12F3N3OS2.ClH/c1-16(9(17)6-3-18-5-14-6)2-8-15-7(4-19-8)10(11,12)13;/h4,6,14H,2-3,5H2,1H3;1H
InChIKeyLERZZCWUMRPMCE-UHFFFAOYSA-N
MW347.82 g/mol
LogP2.20
Rot. Bonds3

About N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride

N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119340397) has the molecular formula C10H13ClF3N3OS2 and a molecular weight of 347.82 g/mol. Its IUPAC name is N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119340397
Molecular FormulaC10H13ClF3N3OS2
Molecular Weight347.82 g/mol
Exact Mass347.01
IUPAC NameN-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCN(Cc1nc(C(F)(F)F)cs1)C(=O)C1CSCN1.Cl
InChIInChI=1S/C10H12F3N3OS2.ClH/c1-16(9(17)6-3-18-5-14-6)2-8-15-7(4-19-8)10(11,12)13;/h4,6,14H,2-3,5H2,1H3;1H
InChIKeyLERZZCWUMRPMCE-UHFFFAOYSA-N
XLogP2.20
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.82
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride with MolForge

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Related Compounds

N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]morpholine-3-carboxamide
CID 119812991
N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]cyclopentanecarboxamide
CID 71983767
3-amino-N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]butanamide;hydrochloride
CID 119813026
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]acetamide
CID 119813017
N-methyl-3-piperidin-4-yl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]butanamide;hydrochloride
CID 119813020
N-[(4-tert-butylphenyl)methyl]-N-methyl-1,3-thiazolidine-4-carboxamide
CID 60938155
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119292510
4-amino-N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]pentanamide
CID 120563759
N,5-dimethyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]pyrazine-2-carboxamide
CID 71983792
2-amino-N-methyl-3-phenyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]propanamide;hydrochloride
CID 84588637
N-[(4-bromophenyl)methyl]-N-methyl-1,3-thiazolidine-4-carboxamide
CID 54869067
N-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1,3-thiazolidine-4-carboxamide
CID 110742655

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119340397) is N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride is CN(Cc1nc(C(F)(F)F)cs1)C(=O)C1CSCN1.Cl.
What is the InChIKey of N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is LERZZCWUMRPMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3OS2.ClH/c1-16(9(17)6-3-18-5-14-6)2-8-15-7(4-19-8)10(11,12)13;/h4,6,14H,2-3,5H2,1H3;1H.
What are the key properties of N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 347.82 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-(trifluoromethyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119340397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).