N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine

C15H22N2 — CID 123758833

IUPACN-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine
SMILESC=N/C1=N/C(C)=CC(C)C/C(C)=C/C1=C/CC
InChIInChI=1S/C15H22N2/c1-6-7-14-10-12(3)8-11(2)9-13(4)17-15(14)16-5/h7,9-11H,5-6,8H2,1-4H3/b12-10+,13-9?,14-7-,17-15+
InChIKeyUMYSSVSPZFIDPH-GWYRIUFMSA-N
MW230.35 g/mol
LogP4.31
Rot. Bonds1

About N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine

N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine (PubChem CID 123758833) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine.

Molecular Properties

Compound NameN-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine
PubChem CID123758833
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine
SMILESC=N/C1=N/C(C)=CC(C)C/C(C)=C/C1=C/CC
InChIInChI=1S/C15H22N2/c1-6-7-14-10-12(3)8-11(2)9-13(4)17-15(14)16-5/h7,9-11H,5-6,8H2,1-4H3/b12-10+,13-9?,14-7-,17-15+
InChIKeyUMYSSVSPZFIDPH-GWYRIUFMSA-N
XLogP4.31
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine?
The IUPAC name of N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine (CID 123758833) is N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine.
What is the SMILES notation for N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine?
The canonical SMILES for N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine is C=N/C1=N/C(C)=CC(C)C/C(C)=C/C1=C/CC.
What is the InChIKey of N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine?
The InChIKey is UMYSSVSPZFIDPH-GWYRIUFMSA-N. The full InChI is InChI=1S/C15H22N2/c1-6-7-14-10-12(3)8-11(2)9-13(4)17-15(14)16-5/h7,9-11H,5-6,8H2,1-4H3/b12-10+,13-9?,14-7-,17-15+.
What are the key properties of N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine?
N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine has a molecular weight of 230.35 g/mol, XLogP of 4.31, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6E,8Z)-2,4,6-trimethyl-8-propylidene-4,5-dihydroazonin-9-yl]methanimine is sourced from PubChem (CID 123758833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).