N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine

C14H19F3N2 — CID 102708824

IUPACN-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine
SMILESCCCNC1CCCC1c1cnccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-2-7-19-13-5-3-4-10(13)11-9-18-8-6-12(11)14(15,16)17/h6,8-10,13,19H,2-5,7H2,1H3
InChIKeyABSFIKUFPMDYDC-UHFFFAOYSA-N
MW272.31 g/mol
LogP3.74
Rot. Bonds4

About N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine

N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine (PubChem CID 102708824) has the molecular formula C14H19F3N2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine
PubChem CID102708824
Molecular FormulaC14H19F3N2
Molecular Weight272.31 g/mol
Exact Mass272.15
IUPAC NameN-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine
SMILESCCCNC1CCCC1c1cnccc1C(F)(F)F
InChIInChI=1S/C14H19F3N2/c1-2-7-19-13-5-3-4-10(13)11-9-18-8-6-12(11)14(15,16)17/h6,8-10,13,19H,2-5,7H2,1H3
InChIKeyABSFIKUFPMDYDC-UHFFFAOYSA-N
XLogP3.74
TPSA24.92 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 ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-methyl-4-(trifluoromethyl)phenyl]-N-propylcyclohexan-1-amine
CID 102755798
3-(2-chlorocycloheptyl)-4-(trifluoromethyl)pyridine
CID 102708804
[2-[4-(trifluoromethyl)-3-pyridinyl]cycloheptyl]methanamine
CID 102709208
2-(2-cyclobutylphenyl)-N-propylcyclopentan-1-amine
CID 114605846
2-(2,5-difluorophenyl)-N-propylcyclopentan-1-amine
CID 62801737
N-methyl-1-[4-methyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanamine
CID 102709252
3-methyl-N-propyl-3-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine
CID 102708933
2-(2-propoxyphenyl)-N-propylcyclopentan-1-amine
CID 104662479
2-methyl-3-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-one
CID 102708865
3-(3-fluoro-4-pyridinyl)-2-methyl-N-propylcyclopentan-1-amine
CID 104739065
N-[[2-(3-fluoro-4-pyridinyl)cyclopentyl]methyl]propan-1-amine
CID 113447373
2-(2,3-dimethylphenyl)-N-propylcyclohexan-1-amine
CID 63510315

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine?
The IUPAC name of N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine (CID 102708824) is N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine.
What is the SMILES notation for N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine?
The canonical SMILES for N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine is CCCNC1CCCC1c1cnccc1C(F)(F)F.
What is the InChIKey of N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine?
The InChIKey is ABSFIKUFPMDYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2/c1-2-7-19-13-5-3-4-10(13)11-9-18-8-6-12(11)14(15,16)17/h6,8-10,13,19H,2-5,7H2,1H3.
What are the key properties of N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine?
N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine has a molecular weight of 272.31 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-[4-(trifluoromethyl)-3-pyridinyl]cyclopentan-1-amine is sourced from PubChem (CID 102708824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).