(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine

C15H29N — CID 178156777

IUPAC(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine
SMILESC/C=C\C(=C/C)CN(CC)CC(CC)CC
InChIInChI=1S/C15H29N/c1-6-11-15(9-4)13-16(10-5)12-14(7-2)8-3/h6,9,11,14H,7-8,10,12-13H2,1-5H3/b11-6-,15-9+
InChIKeyJBJLHBQFZRKKQS-REROGYNISA-N
MW223.40 g/mol
LogP4.27
Rot. Bonds8

About (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine

(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine (PubChem CID 178156777) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine
PubChem CID178156777
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine
SMILESC/C=C\C(=C/C)CN(CC)CC(CC)CC
InChIInChI=1S/C15H29N/c1-6-11-15(9-4)13-16(10-5)12-14(7-2)8-3/h6,9,11,14H,7-8,10,12-13H2,1-5H3/b11-6-,15-9+
InChIKeyJBJLHBQFZRKKQS-REROGYNISA-N
XLogP4.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine 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

(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine
CID 146568641
(Z,2E)-2-ethylidene-N,N-dimethylpent-3-en-1-amine
CID 156713234
(Z,2E)-2-ethylidene-N-methyl-N-(2-methylpropyl)pent-3-en-1-amine
CID 145367899
ethane;ethene;(2Z,4Z)-3-ethylhexa-2,4-diene
CID 144709527
(2R)-1-N-ethyl-1-N-(2-ethylbutyl)propane-1,2-diamine
CID 103934531
ethane;2-[ethyl-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]amino]acetic acid
CID 143432503
N,N-diethyl-2-(phosphanylmethyl)butan-1-amine
CID 59972215
4-[ethyl(2-ethylbutyl)amino]-2-methylbut-2-enoic acid
CID 77076086
(2E,3Z)-N-ethyl-2-ethylidene-N-propylhexa-3,5-dien-1-amine;propane
CID 144845989
2-ethyl-4-[ethyl(2-ethylbutyl)amino]but-2-enoic acid
CID 77101424
1-[2-[ethyl(2-ethylbutyl)amino]acetyl]piperidin-4-one
CID 61437890
1-(2,6-difluorophenyl)-2-[ethyl(2-ethylbutyl)amino]ethanone
CID 61437544

Frequently Asked Questions

What is the IUPAC name of (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine?
The IUPAC name of (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine (CID 178156777) is (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine?
The canonical SMILES for (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine is C/C=C\C(=C/C)CN(CC)CC(CC)CC.
What is the InChIKey of (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine?
The InChIKey is JBJLHBQFZRKKQS-REROGYNISA-N. The full InChI is InChI=1S/C15H29N/c1-6-11-15(9-4)13-16(10-5)12-14(7-2)8-3/h6,9,11,14H,7-8,10,12-13H2,1-5H3/b11-6-,15-9+.
What are the key properties of (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine?
(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.27, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine is sourced from PubChem (CID 178156777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).