N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine

C14H17F3N4S — CID 129342727

IUPACN-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCN(Cc1nccs1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C14H17F3N4S/c1-20(9-13-18-4-5-22-13)6-10-2-3-12-19-11(14(15,16)17)8-21(12)7-10/h4-5,8,10H,2-3,6-7,9H2,1H3/t10-/m0/s1
InChIKeyUXCRZJTWWBDZDZ-JTQLQIEISA-N
MW330.38 g/mol
LogP3.05
Rot. Bonds4

About N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine

N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 129342727) has the molecular formula C14H17F3N4S and a molecular weight of 330.38 g/mol. Its IUPAC name is N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound NameN-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID129342727
Molecular FormulaC14H17F3N4S
Molecular Weight330.38 g/mol
Exact Mass330.11
IUPAC NameN-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCN(Cc1nccs1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C14H17F3N4S/c1-20(9-13-18-4-5-22-13)6-10-2-3-12-19-11(14(15,16)17)8-21(12)7-10/h4-5,8,10H,2-3,6-7,9H2,1H3/t10-/m0/s1
InChIKeyUXCRZJTWWBDZDZ-JTQLQIEISA-N
XLogP3.05
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine 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 N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (CID 129342727) is N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is CN(Cc1nccs1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1.
What is the InChIKey of N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is UXCRZJTWWBDZDZ-JTQLQIEISA-N. The full InChI is InChI=1S/C14H17F3N4S/c1-20(9-13-18-4-5-22-13)6-10-2-3-12-19-11(14(15,16)17)8-21(12)7-10/h4-5,8,10H,2-3,6-7,9H2,1H3/t10-/m0/s1.
What are the key properties of N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 330.38 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,3-thiazol-2-ylmethyl)-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 129342727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).