6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

C14H19F3N2S — CID 102720274

IUPAC6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(SC2CCCCC2)n1
InChIInChI=1S/C14H19F3N2S/c1-2-18-12-8-10(14(15,16)17)9-13(19-12)20-11-6-4-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,18,19)
InChIKeyWXMNOEANJOWPDG-UHFFFAOYSA-N
MW304.38 g/mol
LogP4.96
Rot. Bonds4

About 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine

6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102720274) has the molecular formula C14H19F3N2S and a molecular weight of 304.38 g/mol. Its IUPAC name is 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102720274
Molecular FormulaC14H19F3N2S
Molecular Weight304.38 g/mol
Exact Mass304.12
IUPAC Name6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCNc1cc(C(F)(F)F)cc(SC2CCCCC2)n1
InChIInChI=1S/C14H19F3N2S/c1-2-18-12-8-10(14(15,16)17)9-13(19-12)20-11-6-4-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,18,19)
InChIKeyWXMNOEANJOWPDG-UHFFFAOYSA-N
XLogP4.96
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.38
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-cyclopentylsulfanyl-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720339
[6-cyclohexylsulfanyl-4-(trifluoromethyl)-2-pyridinyl]hydrazine
CID 102721404
6-cyclohexylsulfanyl-N,2-diethylpyrimidin-4-amine
CID 80937260
2-chloro-6-cyclohexylsulfanyl-4-(trifluoromethyl)pyridine
CID 102716318
2-N-ethyl-6-N-(2-methylcyclohexyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717341
2-[[6-(ethylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]cyclohexan-1-ol
CID 102718306
N-ethyl-6-(2-methylcyclohexyl)oxy-4-(trifluoromethyl)pyridin-2-amine
CID 102719705
N-ethyl-6-phenylsulfanyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720209
N-ethyl-6-(4-methylphenyl)sulfanyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720227
N-ethyl-6-piperidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
CID 102717200
6-N-cyclopropyl-2-N,6-N-diethyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717403
N-ethyl-6-(1,3,4-thiadiazol-2-ylsulfanyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102720155

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine (CID 102720274) is 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is CCNc1cc(C(F)(F)F)cc(SC2CCCCC2)n1.
What is the InChIKey of 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is WXMNOEANJOWPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2S/c1-2-18-12-8-10(14(15,16)17)9-13(19-12)20-11-6-4-3-5-7-11/h8-9,11H,2-7H2,1H3,(H,18,19).
What are the key properties of 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine?
6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 304.38 g/mol, XLogP of 4.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexylsulfanyl-N-ethyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102720274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).