N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine

C15H26N2 — CID 123315279

IUPACN'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine
SMILES[H]/N=C/C=N/C(C=CC)=CC(C)CC(C)C(C)C
InChIInChI=1S/C15H26N2/c1-6-7-15(17-9-8-16)11-13(4)10-14(5)12(2)3/h6-9,11-14,16H,10H2,1-5H3/b7-6?,15-11?,16-8+,17-9+
InChIKeyOHBVEZRKRIHOAH-NAEICRBTSA-N
MW234.39 g/mol
LogP4.49
Rot. Bonds7

About N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine

N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine (PubChem CID 123315279) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine.

Molecular Properties

Compound NameN'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine
PubChem CID123315279
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine
SMILES[H]/N=C/C=N/C(C=CC)=CC(C)CC(C)C(C)C
InChIInChI=1S/C15H26N2/c1-6-7-15(17-9-8-16)11-13(4)10-14(5)12(2)3/h6-9,11-14,16H,10H2,1-5H3/b7-6?,15-11?,16-8+,17-9+
InChIKeyOHBVEZRKRIHOAH-NAEICRBTSA-N
XLogP4.49
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,3Z)-3-[(2,4-dimethylcyclobutyl)methylidene]-2-ethylidenepyridine
CID 71206431
CID 88870663
CID 88870663
(1Z,3E)-1-[(4Z)-2-methyl-4-[2-[(Z)-prop-1-enyl]iminoethylidene]cyclobutyl]penta-1,3-dien-3-amine
CID 89011076
N-[(2Z,4Z)-6-ethylnona-2,4-dien-5-yl]ethanimine
CID 89186964
(2E)-2-(ethylideneamino)-5-methylnona-2,8-dien-4-amine
CID 89503499
N-[(7Z)-5-methylcycloocta-1,7-dien-1-yl]prop-2-en-1-imine
CID 91413102
N-(5,6-dimethylnona-1,3-dienyl)prop-2-en-1-imine
CID 91475759
(7-butan-2-yl-8H-cyclohepta[b]pyridin-4-yl)methanamine
CID 91524962
N-(3,5,6-trimethylocta-1,3-dien-2-yl)propan-1-imine
CID 91553754
6-[(Z)-but-1-enyl]-4-ethyl-3-[(3Z,5Z)-hepta-3,5-dien-2-yl]-3,4-dihydropyridine
CID 118616845
N-[(3Z)-5,9-dimethylundeca-1,3-dien-2-yl]ethanimine
CID 123765970
N,N-dimethyl-3-(4,5,6-trimethyl-4,5-dihydro-3H-azepin-7-yl)buta-1,3-dien-1-amine
CID 123833320

Frequently Asked Questions

What is the IUPAC name of N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine?
The IUPAC name of N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine (CID 123315279) is N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine.
What is the SMILES notation for N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine?
The canonical SMILES for N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine is [H]/N=C/C=N/C(C=CC)=CC(C)CC(C)C(C)C.
What is the InChIKey of N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine?
The InChIKey is OHBVEZRKRIHOAH-NAEICRBTSA-N. The full InChI is InChI=1S/C15H26N2/c1-6-7-15(17-9-8-16)11-13(4)10-14(5)12(2)3/h6-9,11-14,16H,10H2,1-5H3/b7-6?,15-11?,16-8+,17-9+.
What are the key properties of N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine?
N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine has a molecular weight of 234.39 g/mol, XLogP of 4.49, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6,8,9-trimethyldeca-2,4-dien-4-yl)ethane-1,2-diimine is sourced from PubChem (CID 123315279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).