7-fluoro-4-methylnon-5-en-3-amine

C10H20FN — CID 91567146

IUPAC7-fluoro-4-methylnon-5-en-3-amine
SMILESCCC(F)C=CC(C)C(N)CC
InChIInChI=1S/C10H20FN/c1-4-9(11)7-6-8(3)10(12)5-2/h6-10H,4-5,12H2,1-3H3
InChIKeyARSYWQANPMNATK-UHFFFAOYSA-N
MW173.28 g/mol
LogP2.66
Rot. Bonds5

About 7-fluoro-4-methylnon-5-en-3-amine

7-fluoro-4-methylnon-5-en-3-amine (PubChem CID 91567146) has the molecular formula C10H20FN and a molecular weight of 173.28 g/mol. Its IUPAC name is 7-fluoro-4-methylnon-5-en-3-amine.

Molecular Properties

Compound Name7-fluoro-4-methylnon-5-en-3-amine
PubChem CID91567146
Molecular FormulaC10H20FN
Molecular Weight173.28 g/mol
Exact Mass173.16
IUPAC Name7-fluoro-4-methylnon-5-en-3-amine
SMILESCCC(F)C=CC(C)C(N)CC
InChIInChI=1S/C10H20FN/c1-4-9(11)7-6-8(3)10(12)5-2/h6-10H,4-5,12H2,1-3H3
InChIKeyARSYWQANPMNATK-UHFFFAOYSA-N
XLogP2.66
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.28
LogP ≤ 52.66
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 7-fluoro-4-methylnon-5-en-3-amine?
The IUPAC name of 7-fluoro-4-methylnon-5-en-3-amine (CID 91567146) is 7-fluoro-4-methylnon-5-en-3-amine.
What is the SMILES notation for 7-fluoro-4-methylnon-5-en-3-amine?
The canonical SMILES for 7-fluoro-4-methylnon-5-en-3-amine is CCC(F)C=CC(C)C(N)CC.
What is the InChIKey of 7-fluoro-4-methylnon-5-en-3-amine?
The InChIKey is ARSYWQANPMNATK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-4-9(11)7-6-8(3)10(12)5-2/h6-10H,4-5,12H2,1-3H3.
What are the key properties of 7-fluoro-4-methylnon-5-en-3-amine?
7-fluoro-4-methylnon-5-en-3-amine has a molecular weight of 173.28 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methylnon-5-en-3-amine is sourced from PubChem (CID 91567146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).