(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide

C19H37N3O — CID 176667535

IUPAC(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide
SMILESCC/C=C\C=C(/C)CCC(=O)NCCCN(C)CCN(C)CC
InChIInChI=1S/C19H37N3O/c1-6-8-9-11-18(3)12-13-19(23)20-14-10-15-22(5)17-16-21(4)7-2/h8-9,11H,6-7,10,12-17H2,1-5H3,(H,20,23)/b9-8-,18-11+
InChIKeyDZQYALDXSJVXQP-YKWGYASXSA-N
MW323.53 g/mol
LogP3.07
Rot. Bonds13

About (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide

(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide (PubChem CID 176667535) has the molecular formula C19H37N3O and a molecular weight of 323.53 g/mol. Its IUPAC name is (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide.

Molecular Properties

Compound Name(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide
PubChem CID176667535
Molecular FormulaC19H37N3O
Molecular Weight323.53 g/mol
Exact Mass323.29
IUPAC Name(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide
SMILESCC/C=C\C=C(/C)CCC(=O)NCCCN(C)CCN(C)CC
InChIInChI=1S/C19H37N3O/c1-6-8-9-11-18(3)12-13-19(23)20-14-10-15-22(5)17-16-21(4)7-2/h8-9,11H,6-7,10,12-17H2,1-5H3,(H,20,23)/b9-8-,18-11+
InChIKeyDZQYALDXSJVXQP-YKWGYASXSA-N
XLogP3.07
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.53
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[3-[3-acetamidopropyl(methyl)amino]propyl]octadec-9-enamide
CID 154225120
N-[3-[2-hydroxyethyl(methyl)amino]propyl]pentadecanamide
CID 102462917
N-[2-[ethyl(methyl)amino]ethyl]-4-(methylamino)butanamide
CID 62641683
(Z)-N-[4-[methyl-[7-[methyl-[3-[[(Z)-octadec-9-enoyl]amino]propyl]amino]heptyl]amino]butyl]octadec-9-enamide;dihydrobromide
CID 172726509
N-[3-(diethylamino)propyl]-4-oxopentanamide
CID 60638247
3-[butyl(methyl)amino]-N-pentadecylpropanamide
CID 58040616
3-[butyl(methyl)amino]-N-(5-hydroxypentyl)propanamide
CID 108795355
3-[butyl(methyl)amino]-N-propylpropanamide
CID 108795247
N-butyl-2-[2-[2-[ethyl(methyl)amino]ethyl-methylamino]ethylamino]acetamide
CID 87733157
7-amino-N-[2-[ethyl(methyl)amino]ethyl]heptanamide;dihydrochloride
CID 119866060
(9Z,12Z,15Z)-N-[3-(dimethylamino)propyl]octadeca-9,12,15-trienamide
CID 155472776
2-[methyl-[3-(octadecanoylamino)propyl]amino]acetic acid
CID 154414053

Frequently Asked Questions

What is the IUPAC name of (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide?
The IUPAC name of (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide (CID 176667535) is (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide.
What is the SMILES notation for (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide?
The canonical SMILES for (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide is CC/C=C\C=C(/C)CCC(=O)NCCCN(C)CCN(C)CC.
What is the InChIKey of (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide?
The InChIKey is DZQYALDXSJVXQP-YKWGYASXSA-N. The full InChI is InChI=1S/C19H37N3O/c1-6-8-9-11-18(3)12-13-19(23)20-14-10-15-22(5)17-16-21(4)7-2/h8-9,11H,6-7,10,12-17H2,1-5H3,(H,20,23)/b9-8-,18-11+.
What are the key properties of (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide?
(4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide has a molecular weight of 323.53 g/mol, XLogP of 3.07, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,6Z)-N-[3-[2-[ethyl(methyl)amino]ethyl-methylamino]propyl]-4-methylnona-4,6-dienamide is sourced from PubChem (CID 176667535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).