4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine

C11H13F3N2S — CID 106748813

IUPAC4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)cc1SC1CCCC1
InChIInChI=1S/C11H13F3N2S/c12-11(13,14)10-5-9(8(15)6-16-10)17-7-3-1-2-4-7/h5-7H,1-4,15H2
InChIKeyLUQAYLVFKKBQBG-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.72
Rot. Bonds2

About 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine

4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 106748813) has the molecular formula C11H13F3N2S and a molecular weight of 262.30 g/mol. Its IUPAC name is 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine
PubChem CID106748813
Molecular FormulaC11H13F3N2S
Molecular Weight262.30 g/mol
Exact Mass262.08
IUPAC Name4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)cc1SC1CCCC1
InChIInChI=1S/C11H13F3N2S/c12-11(13,14)10-5-9(8(15)6-16-10)17-7-3-1-2-4-7/h5-7H,1-4,15H2
InChIKeyLUQAYLVFKKBQBG-UHFFFAOYSA-N
XLogP3.72
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopentylmethylsulfanyl)-6-(trifluoromethyl)pyridin-3-amine
CID 106748815
4-N-cyclobutyl-6-(trifluoromethyl)pyridine-3,4-diamine
CID 104866691
2-cycloheptylsulfanyl-5-(trifluoromethyl)aniline
CID 82927791
4-N-(2-cyclopentylethyl)-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106747365
4-(2-cyclopentylpyrrolidin-1-yl)-6-(trifluoromethyl)pyridin-3-amine
CID 106747600
6-(trifluoromethyl)-4-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpyridin-3-amine
CID 106748835
4-N-(cyclohexylmethyl)-4-N-methyl-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106747423
4-(3,4-dimethylphenyl)sulfanyl-6-(trifluoromethyl)pyridin-3-amine
CID 106748723
4-N-(4,4-dimethylcyclohexyl)-4-N-methyl-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106747912
1-[5-amino-2-(trifluoromethyl)-4-pyridinyl]pyrrolidine-3,4-diol
CID 106748167
4-cyclohexylsulfanyl-1H-pyrazol-5-amine
CID 78969095
4-N-(2,3-dimethylcyclopentyl)-6-(trifluoromethyl)pyridine-3,4-diamine
CID 106747815

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine (CID 106748813) is 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine is Nc1cnc(C(F)(F)F)cc1SC1CCCC1.
What is the InChIKey of 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is LUQAYLVFKKBQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2S/c12-11(13,14)10-5-9(8(15)6-16-10)17-7-3-1-2-4-7/h5-7H,1-4,15H2.
What are the key properties of 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine?
4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 262.30 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentylsulfanyl-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 106748813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).