(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine

C10H16FN — CID 126499829

IUPAC(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine
SMILESC=C/C(F)=C(N)\C=C/CCCC
InChIInChI=1S/C10H16FN/c1-3-5-6-7-8-10(12)9(11)4-2/h4,7-8H,2-3,5-6,12H2,1H3/b8-7-,10-9-
InChIKeyWNKKLZZODGLTCX-QRLRYFCNSA-N
MW169.24 g/mol
LogP3.06
Rot. Bonds5

About (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine

(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine (PubChem CID 126499829) has the molecular formula C10H16FN and a molecular weight of 169.24 g/mol. Its IUPAC name is (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine.

Molecular Properties

Compound Name(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine
PubChem CID126499829
Molecular FormulaC10H16FN
Molecular Weight169.24 g/mol
Exact Mass169.13
IUPAC Name(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine
SMILESC=C/C(F)=C(N)\C=C/CCCC
InChIInChI=1S/C10H16FN/c1-3-5-6-7-8-10(12)9(11)4-2/h4,7-8H,2-3,5-6,12H2,1H3/b8-7-,10-9-
InChIKeyWNKKLZZODGLTCX-QRLRYFCNSA-N
XLogP3.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.24
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine?
The IUPAC name of (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine (CID 126499829) is (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine.
What is the SMILES notation for (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine?
The canonical SMILES for (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine is C=C/C(F)=C(N)\C=C/CCCC.
What is the InChIKey of (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine?
The InChIKey is WNKKLZZODGLTCX-QRLRYFCNSA-N. The full InChI is InChI=1S/C10H16FN/c1-3-5-6-7-8-10(12)9(11)4-2/h4,7-8H,2-3,5-6,12H2,1H3/b8-7-,10-9-.
What are the key properties of (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine?
(3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine has a molecular weight of 169.24 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-3-fluorodeca-1,3,5-trien-4-amine is sourced from PubChem (CID 126499829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).