2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine

C11H20F3NO — CID 66324004

IUPAC2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(CNCC(F)(F)F)OCC1CCCC1
InChIInChI=1S/C11H20F3NO/c1-9(6-15-8-11(12,13)14)16-7-10-4-2-3-5-10/h9-10,15H,2-8H2,1H3
InChIKeyPNVSQIAILRSLCY-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.73
Rot. Bonds6

About 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine

2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine (PubChem CID 66324004) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine.

Molecular Properties

Compound Name2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
PubChem CID66324004
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
SMILESCC(CNCC(F)(F)F)OCC1CCCC1
InChIInChI=1S/C11H20F3NO/c1-9(6-15-8-11(12,13)14)16-7-10-4-2-3-5-10/h9-10,15H,2-8H2,1H3
InChIKeyPNVSQIAILRSLCY-UHFFFAOYSA-N
XLogP2.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Cyclopentyl-6-(trifluoromethyl)morpholine
CID 73994595
N-tert-butyl-2-(4,4-difluoro-5-methylhexoxy)-2-methylpropan-1-amine
CID 88973546
N-(cyclopentylmethyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 61490524
N-methyl-1-[1-(2,2,2-trifluoroethoxy)cyclopentyl]methanamine
CID 62110920
N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]ethanamine
CID 62111088
N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]propan-1-amine
CID 62111089
N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]propan-2-amine
CID 62111090
2-methyl-N-[[1-(2,2,2-trifluoroethoxy)cyclopentyl]methyl]propan-2-amine
CID 62111254
2,2,2-trifluoro-N-[2-(4-methylcyclohexyl)oxyethyl]ethanamine
CID 62566542
2-cyclopentyloxy-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62566678
2-(4-methylcyclohexyl)oxy-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 62566700
2,2,2-trifluoro-N-[2-(2-methylcyclohexyl)oxyethyl]ethanamine
CID 62566905

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The IUPAC name of 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine (CID 66324004) is 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine.
What is the SMILES notation for 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The canonical SMILES for 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine is CC(CNCC(F)(F)F)OCC1CCCC1.
What is the InChIKey of 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine?
The InChIKey is PNVSQIAILRSLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-9(6-15-8-11(12,13)14)16-7-10-4-2-3-5-10/h9-10,15H,2-8H2,1H3.
What are the key properties of 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine?
2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine has a molecular weight of 239.28 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethoxy)-N-(2,2,2-trifluoroethyl)propan-1-amine is sourced from PubChem (CID 66324004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).