(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine

C10H15N — CID 170027215

IUPAC(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine
SMILESC=CC(/C=C\C)=C(N)/C=C\C
InChIInChI=1S/C10H15N/c1-4-7-9(6-3)10(11)8-5-2/h4-8H,3,11H2,1-2H3/b7-4-,8-5-,10-9+
InChIKeyGGZMIZBWMOITOK-VRLBFYMBSA-N
MW149.24 g/mol
LogP2.54
Rot. Bonds3

About (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine

(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine (PubChem CID 170027215) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine.

Molecular Properties

Compound Name(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine
PubChem CID170027215
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine
SMILESC=CC(/C=C\C)=C(N)/C=C\C
InChIInChI=1S/C10H15N/c1-4-7-9(6-3)10(11)8-5-2/h4-8H,3,11H2,1-2H3/b7-4-,8-5-,10-9+
InChIKeyGGZMIZBWMOITOK-VRLBFYMBSA-N
XLogP2.54
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(5E)-3,4-bis(ethenyl)hepta-1,3,5-triene
CID 142110830
(2Z,4E,6Z)-4,5-bis(ethenyl)octa-2,4,6-triene;ethane;propan-2-one
CID 144596817
(5Z)-3-methyl-4-[(Z)-prop-1-enyl]hepta-1,3,5-triene
CID 143367842
(3Z,5Z)-3-N-ethyl-3-N-methylhepta-1,3,5-triene-3,4-diamine
CID 142864476
ethane;(3E,5Z)-4-ethenyl-3-ethylhepta-1,3,5-triene
CID 145032190
(3Z,5Z)-4-prop-1-en-2-ylhepta-1,3,5-trien-3-amine
CID 155176361
ethane;(3Z,5Z)-4-ethenyl-3-ethylhepta-1,3,5-triene
CID 143972745
(2Z)-3-amino-2-[(Z)-prop-1-enyl]penta-2,4-dienenitrile
CID 142139467
(2Z,4E,6Z)-5,6-dimethylocta-2,4,6-trien-4-amine
CID 154950362
(3Z,5Z)-hepta-1,3,5-trien-4-amine
CID 171106725
(3E,5Z,7Z)-6-methylnona-1,3,5,7-tetraen-3-amine
CID 143332399
(6Z)-3,5-dimethylideneocta-1,6-diene
CID 142353486

Frequently Asked Questions

What is the IUPAC name of (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine?
The IUPAC name of (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine (CID 170027215) is (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine.
What is the SMILES notation for (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine?
The canonical SMILES for (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine is C=CC(/C=C\C)=C(N)/C=C\C.
What is the InChIKey of (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine?
The InChIKey is GGZMIZBWMOITOK-VRLBFYMBSA-N. The full InChI is InChI=1S/C10H15N/c1-4-7-9(6-3)10(11)8-5-2/h4-8H,3,11H2,1-2H3/b7-4-,8-5-,10-9+.
What are the key properties of (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine?
(2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine has a molecular weight of 149.24 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4E,6Z)-5-ethenylocta-2,4,6-trien-4-amine is sourced from PubChem (CID 170027215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).