1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine

C10H17F4NO — CID 104748992

IUPAC1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
SMILESNC(COCC(F)(F)C(F)F)C1CCCC1
InChIInChI=1S/C10H17F4NO/c11-9(12)10(13,14)6-16-5-8(15)7-3-1-2-4-7/h7-9H,1-6,15H2
InChIKeyBKASMKLNNGDJHU-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.42
Rot. Bonds6

About 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine

1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine (PubChem CID 104748992) has the molecular formula C10H17F4NO and a molecular weight of 243.24 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
PubChem CID104748992
Molecular FormulaC10H17F4NO
Molecular Weight243.24 g/mol
Exact Mass243.12
IUPAC Name1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
SMILESNC(COCC(F)(F)C(F)F)C1CCCC1
InChIInChI=1S/C10H17F4NO/c11-9(12)10(13,14)6-16-5-8(15)7-3-1-2-4-7/h7-9H,1-6,15H2
InChIKeyBKASMKLNNGDJHU-UHFFFAOYSA-N
XLogP2.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclohexyl-2-(2,2-difluoroethoxy)ethanamine
CID 104749696
1-cyclobutyl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-amine
CID 103474803
1-(5-oxaspiro[3.5]nonan-8-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanamine
CID 103475216
1-cyclopentyl-2-(3,3,3-trifluoropropoxy)ethanamine
CID 104749713
[1-cyclopropyl-2-(2,2,3,3-tetrafluoropropoxy)ethyl]hydrazine
CID 103477623
N-[1-cyclohexyl-2-(2,2,3,3-tetrafluoropropoxy)ethyl]propan-1-amine
CID 104748998
1-(oxan-4-yl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-amine
CID 103474954
1-cyclobutyl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol
CID 103473987
1-(4-methylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215449
1-(oxan-4-yl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103215269
1-(2,2,3,3-tetrafluoropropoxy)but-3-en-2-amine
CID 103474862
1-(oxolan-3-yl)-2-(2,2,3,3-tetrafluoropropoxy)ethanol
CID 104753405

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine?
The IUPAC name of 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine (CID 104748992) is 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine.
What is the SMILES notation for 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine?
The canonical SMILES for 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine is NC(COCC(F)(F)C(F)F)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine?
The InChIKey is BKASMKLNNGDJHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F4NO/c11-9(12)10(13,14)6-16-5-8(15)7-3-1-2-4-7/h7-9H,1-6,15H2.
What are the key properties of 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine?
1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine has a molecular weight of 243.24 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2,2,3,3-tetrafluoropropoxy)ethanamine is sourced from PubChem (CID 104748992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).