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

C11H10F3N3S — CID 66328284

IUPACN-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccnc(NCCc2nccs2)c1
InChIInChI=1S/C11H10F3N3S/c12-11(13,14)8-1-3-15-9(7-8)16-4-2-10-17-5-6-18-10/h1,3,5-7H,2,4H2,(H,15,16)
InChIKeySFMWEIMEGXGXMJ-UHFFFAOYSA-N
MW273.28 g/mol
LogP3.21
Rot. Bonds4

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

N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 66328284) has the molecular formula C11H10F3N3S and a molecular weight of 273.28 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
PubChem CID66328284
Molecular FormulaC11H10F3N3S
Molecular Weight273.28 g/mol
Exact Mass273.05
IUPAC NameN-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccnc(NCCc2nccs2)c1
InChIInChI=1S/C11H10F3N3S/c12-11(13,14)8-1-3-15-9(7-8)16-4-2-10-17-5-6-18-10/h1,3,5-7H,2,4H2,(H,15,16)
InChIKeySFMWEIMEGXGXMJ-UHFFFAOYSA-N
XLogP3.21
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.28
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1,3-thiazol-2-yl)ethyl]-3-(trifluoromethyl)aniline
CID 82539157
1-N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)benzene-1,2-diamine
CID 55218592
2-[2-(1,3-thiazol-2-yl)ethylamino]pyridine-4-carboxylic acid
CID 55219063
N-(5-chloropentyl)-4-(trifluoromethyl)pyridin-2-amine
CID 107320732
6-N-ethyl-4-N-[2-(1,3-thiazol-2-yl)ethyl]-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771926
N-prop-2-ynyl-4-(trifluoromethyl)pyridin-2-amine
CID 45158546
N-octyl-4-(trifluoromethyl)pyridin-2-amine
CID 115568897
4-[[4-(trifluoromethyl)-2-pyridinyl]amino]butan-2-ol
CID 66329465
N-(3-chlorobutyl)-4-(trifluoromethyl)pyridin-2-amine
CID 66330886
N-(2-methyl-2-thiophen-2-ylpropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 80528200
N-propyl-6-(1,3-thiazol-2-ylmethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716803
N-(2-ethoxy-2-methylpropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 114943044

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine (CID 66328284) is N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1ccnc(NCCc2nccs2)c1.
What is the InChIKey of N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is SFMWEIMEGXGXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3S/c12-11(13,14)8-1-3-15-9(7-8)16-4-2-10-17-5-6-18-10/h1,3,5-7H,2,4H2,(H,15,16).
What are the key properties of N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine?
N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 273.28 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-2-yl)ethyl]-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 66328284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).