(Z)-N,N'-dimethylbut-2-enimidamide

C6H12N2 — CID 58400962

IUPAC(Z)-N,N'-dimethylbut-2-enimidamide
SMILESC/C=C\C(=N\C)NC
InChIInChI=1S/C6H12N2/c1-4-5-6(7-2)8-3/h4-5H,1-3H3,(H,7,8)/b5-4-
InChIKeySHVFXRHQNVCNFM-PLNGDYQASA-N
MW112.18 g/mol
LogP0.81
Rot. Bonds1

About (Z)-N,N'-dimethylbut-2-enimidamide

(Z)-N,N'-dimethylbut-2-enimidamide (PubChem CID 58400962) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is (Z)-N,N'-dimethylbut-2-enimidamide.

Molecular Properties

Compound Name(Z)-N,N'-dimethylbut-2-enimidamide
PubChem CID58400962
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name(Z)-N,N'-dimethylbut-2-enimidamide
SMILESC/C=C\C(=N\C)NC
InChIInChI=1S/C6H12N2/c1-4-5-6(7-2)8-3/h4-5H,1-3H3,(H,7,8)/b5-4-
InChIKeySHVFXRHQNVCNFM-PLNGDYQASA-N
XLogP0.81
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.81
H-Bond Donors ≤ 51
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-[N-methyl-C-[(Z)-prop-1-enyl]carbonimidoyl]acetamide
CID 142272541
N,N'-dimethyl-2-methyliminoethanimidamide
CID 90453900
(2Z,4Z,6Z)-4-N,5-N-dimethylocta-2,4,6-triene-4,5-diamine
CID 170199054
N-(4-chlorophenyl)-N'-methylbut-2-enimidamide
CID 123435966
(Z)-N-methyl-2-methyliminopent-3-en-1-amine
CID 143155280
(Z)-N,N'-dimethyl-4-piperidin-4-ylbut-2-enimidamide
CID 144744633
(2E)-N-amino-N',3-dimethyl-4-methylidenehepta-2,5-dienimidamide
CID 91280064
N'-methyl-2-oxo-N-[(Z)-prop-1-enyl]ethanimidamide
CID 126606016
1-N,2-N-dimethylpent-3-ene-1,2-diimine
CID 123282638
(2Z,4Z)-3-(methylamino)hexa-2,4-dien-2-ol
CID 156745357
(E)-N'-aminobut-2-enimidamide
CID 142083872
(Z)-N-[diphenyl-(4-propan-2-ylphenyl)methyl]-N'-methylbut-2-enimidamide
CID 142874586

Frequently Asked Questions

What is the IUPAC name of (Z)-N,N'-dimethylbut-2-enimidamide?
The IUPAC name of (Z)-N,N'-dimethylbut-2-enimidamide (CID 58400962) is (Z)-N,N'-dimethylbut-2-enimidamide.
What is the SMILES notation for (Z)-N,N'-dimethylbut-2-enimidamide?
The canonical SMILES for (Z)-N,N'-dimethylbut-2-enimidamide is C/C=C\C(=N\C)NC.
What is the InChIKey of (Z)-N,N'-dimethylbut-2-enimidamide?
The InChIKey is SHVFXRHQNVCNFM-PLNGDYQASA-N. The full InChI is InChI=1S/C6H12N2/c1-4-5-6(7-2)8-3/h4-5H,1-3H3,(H,7,8)/b5-4-.
What are the key properties of (Z)-N,N'-dimethylbut-2-enimidamide?
(Z)-N,N'-dimethylbut-2-enimidamide has a molecular weight of 112.18 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N'-dimethylbut-2-enimidamide is sourced from PubChem (CID 58400962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).