(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine

C8H18N2 — CID 163252486

IUPAC(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine
SMILESCC/C(=C\NC)N(C)CC
InChIInChI=1S/C8H18N2/c1-5-8(7-9-3)10(4)6-2/h7,9H,5-6H2,1-4H3/b8-7+
InChIKeyRHCGGLXEJMREAE-BQYQJAHWSA-N
MW142.25 g/mol
LogP1.41
Rot. Bonds4

About (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine

(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine (PubChem CID 163252486) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine.

Molecular Properties

Compound Name(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine
PubChem CID163252486
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine
SMILESCC/C(=C\NC)N(C)CC
InChIInChI=1S/C8H18N2/c1-5-8(7-9-3)10(4)6-2/h7,9H,5-6H2,1-4H3/b8-7+
InChIKeyRHCGGLXEJMREAE-BQYQJAHWSA-N
XLogP1.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine 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

2-[ethyl(methyl)amino]-2-oxoacetic acid;N-methylmethanamine
CID 19887909
N,N-dimethylethanamine;N-methylmethanamine;dihydroiodide
CID 158364938
N-[(Z)-2-[ethyl(methyl)amino]but-2-enyl]-2-oxobutanamide;molecular hydrogen
CID 168919619
(1Z,3Z)-2-ethyl-N-methylpenta-1,3-dien-1-amine
CID 144719096
(E)-2-bromo-N-methylbut-1-en-1-amine
CID 139541532
(E)-N-methyl-N-propylhex-3-en-3-amine
CID 155199527
[[ethyl(methyl)amino]-(methylamino)methylidene]-dimethylazanium
CID 87811243
N-ethyl-N-methyl-N'-(methylamino)ethanimidamide
CID 166786257
N-ethyl-N-methyl-2-(methylamino)acetamide
CID 18683928
1,3-diethyl-1,3-dimethylselenourea
CID 134989232
(Z)-N,2-diethyl-N-methylbut-2-enamide
CID 172631579
N-ethyl-N-methylbuta-1,3-dien-2-amine
CID 123199652

Frequently Asked Questions

What is the IUPAC name of (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine?
The IUPAC name of (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine (CID 163252486) is (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine.
What is the SMILES notation for (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine?
The canonical SMILES for (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine is CC/C(=C\NC)N(C)CC.
What is the InChIKey of (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine?
The InChIKey is RHCGGLXEJMREAE-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H18N2/c1-5-8(7-9-3)10(4)6-2/h7,9H,5-6H2,1-4H3/b8-7+.
What are the key properties of (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine?
(E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine has a molecular weight of 142.25 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-N-ethyl-1-N,2-N-dimethylbut-1-ene-1,2-diamine is sourced from PubChem (CID 163252486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).