(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine

C10H17N — CID 166102143

IUPAC(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine
SMILESC=C(/C=C\C(C)=C/CC)NC
InChIInChI=1S/C10H17N/c1-5-6-9(2)7-8-10(3)11-4/h6-8,11H,3,5H2,1-2,4H3/b8-7-,9-6-
InChIKeyALGDMZITBUDGGU-QOCNPQIPSA-N
MW151.25 g/mol
LogP2.63
Rot. Bonds4

About (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine

(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine (PubChem CID 166102143) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine.

Molecular Properties

Compound Name(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine
PubChem CID166102143
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine
SMILESC=C(/C=C\C(C)=C/CC)NC
InChIInChI=1S/C10H17N/c1-5-6-9(2)7-8-10(3)11-4/h6-8,11H,3,5H2,1-2,4H3/b8-7-,9-6-
InChIKeyALGDMZITBUDGGU-QOCNPQIPSA-N
XLogP2.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine?
The IUPAC name of (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine (CID 166102143) is (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine.
What is the SMILES notation for (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine?
The canonical SMILES for (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine is C=C(/C=C\C(C)=C/CC)NC.
What is the InChIKey of (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine?
The InChIKey is ALGDMZITBUDGGU-QOCNPQIPSA-N. The full InChI is InChI=1S/C10H17N/c1-5-6-9(2)7-8-10(3)11-4/h6-8,11H,3,5H2,1-2,4H3/b8-7-,9-6-.
What are the key properties of (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine?
(3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-N,5-dimethylocta-1,3,5-trien-2-amine is sourced from PubChem (CID 166102143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).