4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine

C7H7F3N2S — CID 118248035

IUPAC4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCSc1ccnc(N)c1C(F)(F)F
InChIInChI=1S/C7H7F3N2S/c1-13-4-2-3-12-6(11)5(4)7(8,9)10/h2-3H,1H3,(H2,11,12)
InChIKeyBSWLHGPXLZSJRZ-UHFFFAOYSA-N
MW208.21 g/mol
LogP2.40
Rot. Bonds1

About 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine

4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 118248035) has the molecular formula C7H7F3N2S and a molecular weight of 208.21 g/mol. Its IUPAC name is 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine
PubChem CID118248035
Molecular FormulaC7H7F3N2S
Molecular Weight208.21 g/mol
Exact Mass208.03
IUPAC Name4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCSc1ccnc(N)c1C(F)(F)F
InChIInChI=1S/C7H7F3N2S/c1-13-4-2-3-12-6(11)5(4)7(8,9)10/h2-3H,1H3,(H2,11,12)
InChIKeyBSWLHGPXLZSJRZ-UHFFFAOYSA-N
XLogP2.40
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-methylbutan-2-ylsulfanyl)-3-(trifluoromethyl)pyridin-2-amine
CID 135228327
4-chloro-3-(trifluoromethyl)pyridin-2-amine;ethane
CID 167491380
ethane;3-methylsulfanylpyridin-2-amine
CID 142810881
4-tert-butyl-3-fluoropyridin-2-amine
CID 126653136
4-methylsulfanyl-2,3-bis(trifluoromethyl)phenol
CID 119008895
4-methylsulfanyl-2-propan-2-ylpyridin-3-amine
CID 155344987
[2-amino-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 118704003
2-methoxy-3-(trifluoromethyl)pyridin-4-amine
CID 118806319
2-bromo-3-(trifluoromethyl)pyridin-4-amine
CID 118846163
3-(2,3,4,5,6-pentachlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 134618434
3-(1-methylcyclobutyl)-4-(trifluoromethyl)pyridin-2-amine
CID 150328576
4-methylsulfanyl-5-(trifluoromethyl)benzene-1,2-diamine
CID 134459780

Frequently Asked Questions

What is the IUPAC name of 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine (CID 118248035) is 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine is CSc1ccnc(N)c1C(F)(F)F.
What is the InChIKey of 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is BSWLHGPXLZSJRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2S/c1-13-4-2-3-12-6(11)5(4)7(8,9)10/h2-3H,1H3,(H2,11,12).
What are the key properties of 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine?
4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 208.21 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsulfanyl-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 118248035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).