3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine

C14H19F3N2 — CID 102709687

IUPAC3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
SMILESNC(CCC1CCCC1)c1cnccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c15-14(16,17)12-7-8-19-9-11(12)13(18)6-5-10-3-1-2-4-10/h7-10,13H,1-6,18H2
InChIKeyFKGDPPZAMNWZNO-UHFFFAOYSA-N
MW272.31 g/mol
LogP4.07
Rot. Bonds4

About 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine

3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine (PubChem CID 102709687) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
PubChem CID102709687
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC Name3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine
SMILESNC(CCC1CCCC1)c1cnccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c15-14(16,17)12-7-8-19-9-11(12)13(18)6-5-10-3-1-2-4-10/h7-10,13H,1-6,18H2
InChIKeyFKGDPPZAMNWZNO-UHFFFAOYSA-N
XLogP4.07
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-1-isoquinolin-8-ylpropan-1-amine
CID 103136749
[cycloheptyl-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710352
3-cyclopentyl-1-isoquinolin-4-ylpropan-1-amine
CID 115856292
(4,4-difluorocyclohexyl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102710009
[(2,2-dimethylcyclohexyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 107195010
(3-ethylcyclopentyl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708268
2-(4-bromophenyl)-1-[4-(trifluoromethyl)-3-pyridinyl]ethanamine
CID 102707963
2-(2,6-difluorophenyl)-1-[4-(trifluoromethyl)-3-pyridinyl]ethanamine
CID 102710047
[(1,1-dioxothian-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710467
[thiolan-2-yl-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710391
4-(4-cyclohexylbutan-2-yl)-3-methylpyridine
CID 21279033
[(2,2-dimethylcyclopropyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 107005897

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine?
The IUPAC name of 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine (CID 102709687) is 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine is NC(CCC1CCCC1)c1cnccc1C(F)(F)F.
What is the InChIKey of 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine?
The InChIKey is FKGDPPZAMNWZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c15-14(16,17)12-7-8-19-9-11(12)13(18)6-5-10-3-1-2-4-10/h7-10,13H,1-6,18H2.
What are the key properties of 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine?
3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine has a molecular weight of 272.31 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-[4-(trifluoromethyl)-3-pyridinyl]propan-1-amine is sourced from PubChem (CID 102709687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).