N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine

C12H12F3N3S — CID 63091586

IUPACN-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine
SMILESCc1csc(C(C)Nc2cccc(C(F)(F)F)n2)n1
InChIInChI=1S/C12H12F3N3S/c1-7-6-19-11(16-7)8(2)17-10-5-3-4-9(18-10)12(13,14)15/h3-6,8H,1-2H3,(H,17,18)
InChIKeyMNBMTZXBAKIXFX-UHFFFAOYSA-N
MW287.31 g/mol
LogP4.04
Rot. Bonds3

About N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine

N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine (PubChem CID 63091586) has the molecular formula C12H12F3N3S and a molecular weight of 287.31 g/mol. Its IUPAC name is N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine
PubChem CID63091586
Molecular FormulaC12H12F3N3S
Molecular Weight287.31 g/mol
Exact Mass287.07
IUPAC NameN-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine
SMILESCc1csc(C(C)Nc2cccc(C(F)(F)F)n2)n1
InChIInChI=1S/C12H12F3N3S/c1-7-6-19-11(16-7)8(2)17-10-5-3-4-9(18-10)12(13,14)15/h3-6,8H,1-2H3,(H,17,18)
InChIKeyMNBMTZXBAKIXFX-UHFFFAOYSA-N
XLogP4.04
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.31
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(4-Fluoro-phenyl)-thiazol-2-yl]-(6-methyl-pyridin-2-yl)-amine
CID 972722
N-(pyridin-2-yl)-4-(pyridin-2-yl)thiazol-2-amine
CID 772885
N-Phenyl-4-(2-pyridinyl)-2-thiazolamine
CID 873000
6-methyl-N-[4-(2-pyridinyl)-1,3-thiazol-2-yl]-2-pyridinamine
CID 972317
1,1,1-trifluoro-N-[5-[(4-pyridin-2-yl-1,3-thiazol-2-yl)amino]pentyl]methanesulfonamide
CID 20647087
(6-Methyl-pyridin-2-yl)-(4-thiophen-2-yl-thiazol-2-yl)-amine
CID 973018
N-(2-fluorophenyl)-4-(2-pyridyl)thiazol-2-amine
CID 1092460
4-(1-amino-2-methylpropyl)-N-[5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazol-2-amine
CID 46943064
N-(4-fluorophenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrobromide
CID 91800824
4-N-(3-fluorophenyl)-2-N-propan-2-yl-6-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-1,3,5-triazine-2,4-diamine
CID 89683962
N-(4-fluorophenyl)-4-(pyridin-2-yl)-1,3-thiazol-2-amine
CID 972907
4-(6-(Acetamidomethyl)pyridin-2-yl)-2-guanidinothiazole
CID 10446940

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine (CID 63091586) is N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine is Cc1csc(C(C)Nc2cccc(C(F)(F)F)n2)n1.
What is the InChIKey of N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine?
The InChIKey is MNBMTZXBAKIXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F3N3S/c1-7-6-19-11(16-7)8(2)17-10-5-3-4-9(18-10)12(13,14)15/h3-6,8H,1-2H3,(H,17,18).
What are the key properties of N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine?
N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine has a molecular weight of 287.31 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 63091586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).