6-ethenylocta-1,7-dien-3-imine

C10H15N — CID 163963706

IUPAC6-ethenylocta-1,7-dien-3-imine
SMILES[H]/N=C(\C=C)CCC(C=C)C=C
InChIInChI=1S/C10H15N/c1-4-9(5-2)7-8-10(11)6-3/h4-6,9,11H,1-3,7-8H2/b11-10+
InChIKeySJTQUFPUJVTEJT-ZHACJKMWSA-N
MW149.24 g/mol
LogP2.96
Rot. Bonds6

About 6-ethenylocta-1,7-dien-3-imine

6-ethenylocta-1,7-dien-3-imine (PubChem CID 163963706) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 6-ethenylocta-1,7-dien-3-imine.

Molecular Properties

Compound Name6-ethenylocta-1,7-dien-3-imine
PubChem CID163963706
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name6-ethenylocta-1,7-dien-3-imine
SMILES[H]/N=C(\C=C)CCC(C=C)C=C
InChIInChI=1S/C10H15N/c1-4-9(5-2)7-8-10(11)6-3/h4-6,9,11H,1-3,7-8H2/b11-10+
InChIKeySJTQUFPUJVTEJT-ZHACJKMWSA-N
XLogP2.96
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 6-ethenylocta-1,7-dien-3-imine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methylcyclohex-2-en-1-imine
CID 86188352
5-(2-Ethenylcyclopropyl)pent-1-en-3-imine
CID 90754586
2-Methyloct-5-en-4-imine
CID 90985822
(Z)-6-methylhept-2-en-4-imine
CID 91390862
(2Z)-6-methylnona-2,7-dien-4-imine
CID 91416730
4-Methylhept-5-en-2-imine
CID 91433524
4-Methylhept-6-en-3-imine
CID 123204332
4-Methylhept-6-en-2-imine
CID 123395995
3-Propyloct-7-en-2-imine
CID 123397388
6-Ethylcyclohex-2-en-1-imine
CID 123419578
3-Methylidenehept-6-en-2-imine
CID 123545228
3-Methyldec-1-en-5-imine
CID 123614740

Frequently Asked Questions

What is the IUPAC name of 6-ethenylocta-1,7-dien-3-imine?
The IUPAC name of 6-ethenylocta-1,7-dien-3-imine (CID 163963706) is 6-ethenylocta-1,7-dien-3-imine.
What is the SMILES notation for 6-ethenylocta-1,7-dien-3-imine?
The canonical SMILES for 6-ethenylocta-1,7-dien-3-imine is [H]/N=C(\C=C)CCC(C=C)C=C.
What is the InChIKey of 6-ethenylocta-1,7-dien-3-imine?
The InChIKey is SJTQUFPUJVTEJT-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H15N/c1-4-9(5-2)7-8-10(11)6-3/h4-6,9,11H,1-3,7-8H2/b11-10+.
What are the key properties of 6-ethenylocta-1,7-dien-3-imine?
6-ethenylocta-1,7-dien-3-imine has a molecular weight of 149.24 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenylocta-1,7-dien-3-imine is sourced from PubChem (CID 163963706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).