N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine

C7H7F3N2S — CID 133058074

IUPACN-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine
SMILESCNc1ncccc1SC(F)(F)F
InChIInChI=1S/C7H7F3N2S/c1-11-6-5(3-2-4-12-6)13-7(8,9)10/h2-4H,1H3,(H,11,12)
InChIKeyIGJNVJODQIBCDS-UHFFFAOYSA-N
MW208.21 g/mol
LogP2.74
Rot. Bonds2

About N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine

N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine (PubChem CID 133058074) has the molecular formula C7H7F3N2S and a molecular weight of 208.21 g/mol. Its IUPAC name is N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine
PubChem CID133058074
Molecular FormulaC7H7F3N2S
Molecular Weight208.21 g/mol
Exact Mass208.03
IUPAC NameN-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine
SMILESCNc1ncccc1SC(F)(F)F
InChIInChI=1S/C7H7F3N2S/c1-11-6-5(3-2-4-12-6)13-7(8,9)10/h2-4H,1H3,(H,11,12)
InChIKeyIGJNVJODQIBCDS-UHFFFAOYSA-N
XLogP2.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Pyridinamine, N-methyl-
CID 20727
Thiourea, N-butyl-N'-2-pyridinyl-
CID 3038252
2-(2-Thenylamino)pyridine
CID 67323
1-(2-Pyridyl)-2-thiourea
CID 1490491
2-Amino-3-fluoropyridine
CID 2762809
2-(Ethylamino)pyridine
CID 11804745
3-fluoro-N-methylpyridin-2-amine
CID 10678237
5-(Tert-butylthio)pyridin-2-amine hydrochloride
CID 6603337
(6-Methyl-pyridin-2-yl)-(3-methylsulfanyl-pyridin-2-yl)-amine
CID 44404932
Urea, 1-ethyl-3-(2-pyridyl)-2-thio-
CID 3037985
N'-Propyl-N-pyridin-2-ylcarbamimidothioic acid
CID 3056821
4-(Methylsulfanyl)pyridin-2-amine
CID 9877393

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine?
The IUPAC name of N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine (CID 133058074) is N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine?
The canonical SMILES for N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine is CNc1ncccc1SC(F)(F)F.
What is the InChIKey of N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine?
The InChIKey is IGJNVJODQIBCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2S/c1-11-6-5(3-2-4-12-6)13-7(8,9)10/h2-4H,1H3,(H,11,12).
What are the key properties of N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine?
N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine has a molecular weight of 208.21 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(trifluoromethylsulfanyl)pyridin-2-amine is sourced from PubChem (CID 133058074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).