N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide

C15H24N2 — CID 138483254

IUPACN'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C/C=C/C(=C\CC=C(C)C)CC
InChIInChI=1S/C15H24N2/c1-6-15(10-7-9-13(2)3)11-8-12-17-14(4)16-5/h8-11H,5-7,12H2,1-4H3/b11-8+,15-10-,17-14+
InChIKeyLNNNBDYWKXRJQC-MJWWHBMWSA-N
MW232.37 g/mol
LogP4.35
Rot. Bonds6

About N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide

N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide (PubChem CID 138483254) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide.

Molecular Properties

Compound NameN'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide
PubChem CID138483254
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide
SMILESC=N/C(C)=N/C/C=C/C(=C\CC=C(C)C)CC
InChIInChI=1S/C15H24N2/c1-6-15(10-7-9-13(2)3)11-8-12-17-14(4)16-5/h8-11H,5-7,12H2,1-4H3/b11-8+,15-10-,17-14+
InChIKeyLNNNBDYWKXRJQC-MJWWHBMWSA-N
XLogP4.35
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide?
The IUPAC name of N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide (CID 138483254) is N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide.
What is the SMILES notation for N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide?
The canonical SMILES for N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide is C=N/C(C)=N/C/C=C/C(=C\CC=C(C)C)CC.
What is the InChIKey of N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide?
The InChIKey is LNNNBDYWKXRJQC-MJWWHBMWSA-N. The full InChI is InChI=1S/C15H24N2/c1-6-15(10-7-9-13(2)3)11-8-12-17-14(4)16-5/h8-11H,5-7,12H2,1-4H3/b11-8+,15-10-,17-14+.
What are the key properties of N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide?
N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide has a molecular weight of 232.37 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide is sourced from PubChem (CID 138483254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).