(4Z)-6,7-dimethylocta-4,7-dien-1-imine

C10H17N — CID 130384307

IUPAC(4Z)-6,7-dimethylocta-4,7-dien-1-imine
SMILES[H]/N=C/CC/C=C\C(C)C(=C)C
InChIInChI=1S/C10H17N/c1-9(2)10(3)7-5-4-6-8-11/h5,7-8,10-11H,1,4,6H2,2-3H3/b7-5-,11-8+
InChIKeyMVRJYJAEZWIEHC-UKJSTWFMSA-N
MW151.25 g/mol
LogP3.18
Rot. Bonds5

About (4Z)-6,7-dimethylocta-4,7-dien-1-imine

(4Z)-6,7-dimethylocta-4,7-dien-1-imine (PubChem CID 130384307) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (4Z)-6,7-dimethylocta-4,7-dien-1-imine.

Molecular Properties

Compound Name(4Z)-6,7-dimethylocta-4,7-dien-1-imine
PubChem CID130384307
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(4Z)-6,7-dimethylocta-4,7-dien-1-imine
SMILES[H]/N=C/CC/C=C\C(C)C(=C)C
InChIInChI=1S/C10H17N/c1-9(2)10(3)7-5-4-6-8-11/h5,7-8,10-11H,1,4,6H2,2-3H3/b7-5-,11-8+
InChIKeyMVRJYJAEZWIEHC-UKJSTWFMSA-N
XLogP3.18
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4Z)-6,7-dimethylocta-4,7-dien-1-imine?
The IUPAC name of (4Z)-6,7-dimethylocta-4,7-dien-1-imine (CID 130384307) is (4Z)-6,7-dimethylocta-4,7-dien-1-imine.
What is the SMILES notation for (4Z)-6,7-dimethylocta-4,7-dien-1-imine?
The canonical SMILES for (4Z)-6,7-dimethylocta-4,7-dien-1-imine is [H]/N=C/CC/C=C\C(C)C(=C)C.
What is the InChIKey of (4Z)-6,7-dimethylocta-4,7-dien-1-imine?
The InChIKey is MVRJYJAEZWIEHC-UKJSTWFMSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2)10(3)7-5-4-6-8-11/h5,7-8,10-11H,1,4,6H2,2-3H3/b7-5-,11-8+.
What are the key properties of (4Z)-6,7-dimethylocta-4,7-dien-1-imine?
(4Z)-6,7-dimethylocta-4,7-dien-1-imine has a molecular weight of 151.25 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-6,7-dimethylocta-4,7-dien-1-imine is sourced from PubChem (CID 130384307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).