2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine

C10H18FN — CID 89215166

IUPAC2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine
SMILESCC/C=C1/CC(F)CC1CCN
InChIInChI=1S/C10H18FN/c1-2-3-8-6-10(11)7-9(8)4-5-12/h3,9-10H,2,4-7,12H2,1H3/b8-3-
InChIKeyOLLKUKOHIXBJKU-BAQGIRSFSA-N
MW171.26 g/mol
LogP2.42
Rot. Bonds3

About 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine

2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine (PubChem CID 89215166) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine.

Molecular Properties

Compound Name2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine
PubChem CID89215166
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine
SMILESCC/C=C1/CC(F)CC1CCN
InChIInChI=1S/C10H18FN/c1-2-3-8-6-10(11)7-9(8)4-5-12/h3,9-10H,2,4-7,12H2,1H3/b8-3-
InChIKeyOLLKUKOHIXBJKU-BAQGIRSFSA-N
XLogP2.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine?
The IUPAC name of 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine (CID 89215166) is 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine.
What is the SMILES notation for 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine?
The canonical SMILES for 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine is CC/C=C1/CC(F)CC1CCN.
What is the InChIKey of 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine?
The InChIKey is OLLKUKOHIXBJKU-BAQGIRSFSA-N. The full InChI is InChI=1S/C10H18FN/c1-2-3-8-6-10(11)7-9(8)4-5-12/h3,9-10H,2,4-7,12H2,1H3/b8-3-.
What are the key properties of 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine?
2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine has a molecular weight of 171.26 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2Z)-4-fluoro-2-propylidenecyclopentyl]ethanamine is sourced from PubChem (CID 89215166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).