N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine

C15H25N — CID 123978151

IUPACN-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine
SMILESCC=CC(=CC=CCCC)CC/C=N/CC
InChIInChI=1S/C15H25N/c1-4-7-8-9-12-15(11-5-2)13-10-14-16-6-3/h5,8-9,11-12,14H,4,6-7,10,13H2,1-3H3/b9-8?,11-5?,15-12?,16-14+
InChIKeyGRHRJQXHDXHNSY-LPUYKOEHSA-N
MW219.37 g/mol
LogP4.72
Rot. Bonds8

About N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine

N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine (PubChem CID 123978151) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine.

Molecular Properties

Compound NameN-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine
PubChem CID123978151
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC NameN-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine
SMILESCC=CC(=CC=CCCC)CC/C=N/CC
InChIInChI=1S/C15H25N/c1-4-7-8-9-12-15(11-5-2)13-10-14-16-6-3/h5,8-9,11-12,14H,4,6-7,10,13H2,1-3H3/b9-8?,11-5?,15-12?,16-14+
InChIKeyGRHRJQXHDXHNSY-LPUYKOEHSA-N
XLogP4.72
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine 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-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine?
The IUPAC name of N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine (CID 123978151) is N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine.
What is the SMILES notation for N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine?
The canonical SMILES for N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine is CC=CC(=CC=CCCC)CC/C=N/CC.
What is the InChIKey of N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine?
The InChIKey is GRHRJQXHDXHNSY-LPUYKOEHSA-N. The full InChI is InChI=1S/C15H25N/c1-4-7-8-9-12-15(11-5-2)13-10-14-16-6-3/h5,8-9,11-12,14H,4,6-7,10,13H2,1-3H3/b9-8?,11-5?,15-12?,16-14+.
What are the key properties of N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine?
N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine has a molecular weight of 219.37 g/mol, XLogP of 4.72, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-prop-1-enyldeca-4,6-dien-1-imine is sourced from PubChem (CID 123978151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).