(4Z,6Z)-3-ethylocta-4,6-dien-1-amine

C10H19N — CID 89156620

IUPAC(4Z,6Z)-3-ethylocta-4,6-dien-1-amine
SMILESC/C=C\C=C/C(CC)CCN
InChIInChI=1S/C10H19N/c1-3-5-6-7-10(4-2)8-9-11/h3,5-7,10H,4,8-9,11H2,1-2H3/b5-3-,7-6-
InChIKeyPQDWFCQWWJEXMJ-VKLRWAGZSA-N
MW153.27 g/mol
LogP2.49
Rot. Bonds5

About (4Z,6Z)-3-ethylocta-4,6-dien-1-amine

(4Z,6Z)-3-ethylocta-4,6-dien-1-amine (PubChem CID 89156620) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (4Z,6Z)-3-ethylocta-4,6-dien-1-amine.

Molecular Properties

Compound Name(4Z,6Z)-3-ethylocta-4,6-dien-1-amine
PubChem CID89156620
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(4Z,6Z)-3-ethylocta-4,6-dien-1-amine
SMILESC/C=C\C=C/C(CC)CCN
InChIInChI=1S/C10H19N/c1-3-5-6-7-10(4-2)8-9-11/h3,5-7,10H,4,8-9,11H2,1-2H3/b5-3-,7-6-
InChIKeyPQDWFCQWWJEXMJ-VKLRWAGZSA-N
XLogP2.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.49
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 (4Z,6Z)-3-ethylocta-4,6-dien-1-amine?
The IUPAC name of (4Z,6Z)-3-ethylocta-4,6-dien-1-amine (CID 89156620) is (4Z,6Z)-3-ethylocta-4,6-dien-1-amine.
What is the SMILES notation for (4Z,6Z)-3-ethylocta-4,6-dien-1-amine?
The canonical SMILES for (4Z,6Z)-3-ethylocta-4,6-dien-1-amine is C/C=C\C=C/C(CC)CCN.
What is the InChIKey of (4Z,6Z)-3-ethylocta-4,6-dien-1-amine?
The InChIKey is PQDWFCQWWJEXMJ-VKLRWAGZSA-N. The full InChI is InChI=1S/C10H19N/c1-3-5-6-7-10(4-2)8-9-11/h3,5-7,10H,4,8-9,11H2,1-2H3/b5-3-,7-6-.
What are the key properties of (4Z,6Z)-3-ethylocta-4,6-dien-1-amine?
(4Z,6Z)-3-ethylocta-4,6-dien-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,6Z)-3-ethylocta-4,6-dien-1-amine is sourced from PubChem (CID 89156620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).