N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane

C8H16N2 — CID 171620758

IUPACN-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane
SMILESC/C=C\C=N\C=N\C.CC
InChIInChI=1S/C6H10N2.C2H6/c1-3-4-5-8-6-7-2;1-2/h3-6H,1-2H3;1-2H3/b4-3-,7-6+,8-5+;
InChIKeyDBGQXUFYBXGCNQ-XTSIIWEVSA-N
MW140.23 g/mol
LogP2.32
Rot. Bonds2

About N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane

N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane (PubChem CID 171620758) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane.

Molecular Properties

Compound NameN-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane
PubChem CID171620758
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane
SMILESC/C=C\C=N\C=N\C.CC
InChIInChI=1S/C6H10N2.C2H6/c1-3-4-5-8-6-7-2;1-2/h3-6H,1-2H3;1-2H3/b4-3-,7-6+,8-5+;
InChIKeyDBGQXUFYBXGCNQ-XTSIIWEVSA-N
XLogP2.32
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.32
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'}

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Related Compounds

N-[(1E,2Z)-but-2-en-1-ylidene]-N'-[(2E)-but-2-en-1-ylidene]butane-1,4-diamine
CID 49866444
2-Propenimidamide, N-2-propenylidene-N'-2-propenyl-
CID 564453
(Z)-N-[2-[[(Z)-but-2-enylidene]amino]ethyl]but-2-en-1-imine
CID 58708867
N-[3-(but-2-enylideneamino)propyl]but-2-en-1-imine
CID 87313312
N,N'-dimethylbut-2-ene-1,4-diimine
CID 87697025
N-ethylidene-N'-prop-2-enylmethanimidamide
CID 88952463
N'-ethyl-N-prop-2-enylidenemethanimidamide
CID 89196565
N'-methyl-N-prop-2-enylideneethanimidamide
CID 89331290
N'-propan-2-yl-N-prop-2-enylidenemethanimidamide
CID 89423961
N'-methyl-N-(3-methylbut-2-enylidene)methanimidamide
CID 89508370
Metformin Impurity 61
CID 89899673
N-butan-2-ylpyrrol-2-imine
CID 91128749

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane?
The IUPAC name of N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane (CID 171620758) is N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane.
What is the SMILES notation for N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane?
The canonical SMILES for N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane is C/C=C\C=N\C=N\C.CC.
What is the InChIKey of N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane?
The InChIKey is DBGQXUFYBXGCNQ-XTSIIWEVSA-N. The full InChI is InChI=1S/C6H10N2.C2H6/c1-3-4-5-8-6-7-2;1-2/h3-6H,1-2H3;1-2H3/b4-3-,7-6+,8-5+;.
What are the key properties of N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane?
N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane has a molecular weight of 140.23 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-but-2-enylidene]-N'-methylmethanimidamide;ethane is sourced from PubChem (CID 171620758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).