N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane

C10H20N2 — CID 143082462

IUPACN'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane
SMILESC/C=C(C)\N=C(C)\N=C\C.CC
InChIInChI=1S/C8H14N2.C2H6/c1-5-7(3)10-8(4)9-6-2;1-2/h5-6H,1-4H3;1-2H3/b7-5-,9-6+,10-8+;
InChIKeyYZJCMVYEVZQWPZ-BIEUWWLHSA-N
MW168.28 g/mol
LogP3.45
Rot. Bonds1

About N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane

N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane (PubChem CID 143082462) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane.

Molecular Properties

Compound NameN'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane
PubChem CID143082462
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane
SMILESC/C=C(C)\N=C(C)\N=C\C.CC
InChIInChI=1S/C8H14N2.C2H6/c1-5-7(3)10-8(4)9-6-2;1-2/h5-6H,1-4H3;1-2H3/b7-5-,9-6+,10-8+;
InChIKeyYZJCMVYEVZQWPZ-BIEUWWLHSA-N
XLogP3.45
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.45
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'}

Analyze N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane 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'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?
The IUPAC name of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane (CID 143082462) is N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane.
What is the SMILES notation for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?
The canonical SMILES for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane is C/C=C(C)\N=C(C)\N=C\C.CC.
What is the InChIKey of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?
The InChIKey is YZJCMVYEVZQWPZ-BIEUWWLHSA-N. The full InChI is InChI=1S/C8H14N2.C2H6/c1-5-7(3)10-8(4)9-6-2;1-2/h5-6H,1-4H3;1-2H3/b7-5-,9-6+,10-8+;.
What are the key properties of N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane?
N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane has a molecular weight of 168.28 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-but-2-en-2-yl]-N-ethylideneethanimidamide;ethane is sourced from PubChem (CID 143082462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).