2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine

C12H15F3N2 — CID 118326169

IUPAC2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine
SMILESCC1CCCC1(N)c1cc(C(F)(F)F)ccn1
InChIInChI=1S/C12H15F3N2/c1-8-3-2-5-11(8,16)10-7-9(4-6-17-10)12(13,14)15/h4,6-8H,2-3,5,16H2,1H3
InChIKeyGOXOLSOMMVRRFC-UHFFFAOYSA-N
MW244.26 g/mol
LogP3.07
Rot. Bonds1

About 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine

2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine (PubChem CID 118326169) has the molecular formula C12H15F3N2 and a molecular weight of 244.26 g/mol. Its IUPAC name is 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine
PubChem CID118326169
Molecular FormulaC12H15F3N2
Molecular Weight244.26 g/mol
Exact Mass244.12
IUPAC Name2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine
SMILESCC1CCCC1(N)c1cc(C(F)(F)F)ccn1
InChIInChI=1S/C12H15F3N2/c1-8-3-2-5-11(8,16)10-7-9(4-6-17-10)12(13,14)15/h4,6-8H,2-3,5,16H2,1H3
InChIKeyGOXOLSOMMVRRFC-UHFFFAOYSA-N
XLogP3.07
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-[4-(trifluoromethyl)phenyl]cyclohexan-1-amine
CID 62788683
3-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclobutan-1-ol
CID 10014108
2-cyclopentyl-4-(trifluoromethyl)pyridine
CID 144787930
1-(4-fluorophenyl)-2-methylcyclopentan-1-amine
CID 79679805
2-methyl-1-[2-methyl-4-(trifluoromethyl)phenyl]cyclopentan-1-ol
CID 102751617
2-(1-cyclobutylethyl)-4-(trifluoromethyl)pyridine
CID 170081104
trans-(1R,2R)-2-[[4-(trifluoromethyl)-2-pyridinyl]methyl]cyclopentan-1-amine
CID 125470676
2-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]cyclohexan-1-amine
CID 62619930
4-methyl-1-[[4-(trifluoromethyl)-2-pyridinyl]amino]cyclohexane-1-carboxylic acid
CID 66330615
2-[4-(trifluoromethyl)-2-pyridinyl]propan-2-amine
CID 115009349
tert-butyl formate;4-[4-(trifluoromethyl)-2-pyridinyl]piperidin-4-ol
CID 174513331
1-(2,4-difluorophenyl)-2-methylcyclohexan-1-amine
CID 62802200

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine?
The IUPAC name of 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine (CID 118326169) is 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine?
The canonical SMILES for 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine is CC1CCCC1(N)c1cc(C(F)(F)F)ccn1.
What is the InChIKey of 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine?
The InChIKey is GOXOLSOMMVRRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2/c1-8-3-2-5-11(8,16)10-7-9(4-6-17-10)12(13,14)15/h4,6-8H,2-3,5,16H2,1H3.
What are the key properties of 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine?
2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine has a molecular weight of 244.26 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[4-(trifluoromethyl)-2-pyridinyl]cyclopentan-1-amine is sourced from PubChem (CID 118326169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).