2,3-bis(ethenyl)-4-methylpent-4-en-1-imine

C10H15N — CID 143956308

IUPAC2,3-bis(ethenyl)-4-methylpent-4-en-1-imine
SMILES[H]/N=C/C(C=C)C(C=C)C(=C)C
InChIInChI=1S/C10H15N/c1-5-9(7-11)10(6-2)8(3)4/h5-7,9-11H,1-3H2,4H3/b11-7+
InChIKeyVQLUETHMFUMQEH-YRNVUSSQSA-N
MW149.24 g/mol
LogP2.82
Rot. Bonds5

About 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine

2,3-bis(ethenyl)-4-methylpent-4-en-1-imine (PubChem CID 143956308) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine.

Molecular Properties

Compound Name2,3-bis(ethenyl)-4-methylpent-4-en-1-imine
PubChem CID143956308
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name2,3-bis(ethenyl)-4-methylpent-4-en-1-imine
SMILES[H]/N=C/C(C=C)C(C=C)C(=C)C
InChIInChI=1S/C10H15N/c1-5-9(7-11)10(6-2)8(3)4/h5-7,9-11H,1-3H2,4H3/b11-7+
InChIKeyVQLUETHMFUMQEH-YRNVUSSQSA-N
XLogP2.82
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.82
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'}

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine?
The IUPAC name of 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine (CID 143956308) is 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine.
What is the SMILES notation for 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine?
The canonical SMILES for 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine is [H]/N=C/C(C=C)C(C=C)C(=C)C.
What is the InChIKey of 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine?
The InChIKey is VQLUETHMFUMQEH-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H15N/c1-5-9(7-11)10(6-2)8(3)4/h5-7,9-11H,1-3H2,4H3/b11-7+.
What are the key properties of 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine?
2,3-bis(ethenyl)-4-methylpent-4-en-1-imine has a molecular weight of 149.24 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-4-methylpent-4-en-1-imine is sourced from PubChem (CID 143956308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).