N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine

C10H18F3NS — CID 116627267

IUPACN,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
SMILESCNC1CCC(CCSC(F)(F)F)C1C
InChIInChI=1S/C10H18F3NS/c1-7-8(3-4-9(7)14-2)5-6-15-10(11,12)13/h7-9,14H,3-6H2,1-2H3
InChIKeyUAFPADONDOUIFA-UHFFFAOYSA-N
MW241.32 g/mol
LogP3.26
Rot. Bonds4

About N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine

N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine (PubChem CID 116627267) has the molecular formula C10H18F3NS and a molecular weight of 241.32 g/mol. Its IUPAC name is N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
PubChem CID116627267
Molecular FormulaC10H18F3NS
Molecular Weight241.32 g/mol
Exact Mass241.11
IUPAC NameN,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
SMILESCNC1CCC(CCSC(F)(F)F)C1C
InChIInChI=1S/C10H18F3NS/c1-7-8(3-4-9(7)14-2)5-6-15-10(11,12)13/h7-9,14H,3-6H2,1-2H3
InChIKeyUAFPADONDOUIFA-UHFFFAOYSA-N
XLogP3.26
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 103698656
2-ethyl-N-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 103778164
(1S)-1-cyclopentyl-N-[2-(trifluoromethylsulfanyl)ethyl]ethanamine
CID 104891284
(1R)-1-cyclopentyl-N-[2-(trifluoromethylsulfanyl)ethyl]ethanamine
CID 104891285
4,4,4-trifluoro-N-methyl-1-(2-methylthiolan-2-yl)butan-1-amine
CID 105156418
5,5,5-trifluoro-N-methyl-1-(thiolan-3-yl)pentan-1-amine
CID 105174375
N-[(2-methylcyclopentyl)methyl]-2-(trifluoromethylsulfanyl)ethanamine
CID 107418282
1-cyclopentyl-N-ethyl-4-(trifluoromethylsulfanyl)butan-1-amine
CID 113544027
2-cyclopentyl-N-ethyl-4-(trifluoromethylsulfanyl)butan-1-amine
CID 113544197
N-[2-cyclopentyl-4-(trifluoromethylsulfanyl)butyl]cyclopropanamine
CID 113544198
2-methyl-N-propyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine
CID 113545360
N-[[2-[2-(trifluoromethylsulfanyl)ethyl]cyclopentyl]methyl]propan-2-amine
CID 113545474

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine?
The IUPAC name of N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine (CID 116627267) is N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine?
The canonical SMILES for N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine is CNC1CCC(CCSC(F)(F)F)C1C.
What is the InChIKey of N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine?
The InChIKey is UAFPADONDOUIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NS/c1-7-8(3-4-9(7)14-2)5-6-15-10(11,12)13/h7-9,14H,3-6H2,1-2H3.
What are the key properties of N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine?
N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine has a molecular weight of 241.32 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-3-[2-(trifluoromethylsulfanyl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 116627267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).