N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide

C8H14N2 — CID 123265580

IUPACN-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide
SMILESC=CN/C(C)=N/C=C(C)C
InChIInChI=1S/C8H14N2/c1-5-9-8(4)10-6-7(2)3/h5-6H,1H2,2-4H3,(H,9,10)
InChIKeyQEXUFHRZORHQSG-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.06
Rot. Bonds2

About N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide

N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide (PubChem CID 123265580) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide
PubChem CID123265580
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC NameN-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide
SMILESC=CN/C(C)=N/C=C(C)C
InChIInChI=1S/C8H14N2/c1-5-9-8(4)10-6-7(2)3/h5-6H,1H2,2-4H3,(H,9,10)
InChIKeyQEXUFHRZORHQSG-UHFFFAOYSA-N
XLogP2.06
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.06
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

2-Methyl-1,4-dihydropyrimidine
CID 13432429
2-Methyl-1H-1,3-diazepine
CID 56992381
2,5-Dimethyl-1,4-dihydropyrimidine
CID 69038475
N'-methyl-N-[(Z)-prop-1-enyl]ethanimidamide
CID 87171545
N-ethenyl-N'-ethylethanimidamide
CID 87281065
N-[(Z)-but-1-enyl]-N'-methylethanimidamide
CID 89347354
N-ethenyl-N'-prop-1-enylbutanimidamide
CID 91047825
N,N'-bis(prop-1-enyl)ethanimidamide
CID 91212517
N-ethenyl-N'-methylethanimidamide
CID 91237354
N-[(1E)-buta-1,3-dienyl]-N'-methylpropanimidamide
CID 118486678
2,5-dimethyl-4,5-dihydro-1H-1,3-diazepine
CID 123227184
(8E)-2-methyl-6,7-dihydro-1H-1,3-diazonine
CID 123300903

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide?
The IUPAC name of N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide (CID 123265580) is N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide.
What is the SMILES notation for N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide?
The canonical SMILES for N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide is C=CN/C(C)=N/C=C(C)C.
What is the InChIKey of N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide?
The InChIKey is QEXUFHRZORHQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-9-8(4)10-6-7(2)3/h5-6H,1H2,2-4H3,(H,9,10).
What are the key properties of N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide?
N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide has a molecular weight of 138.21 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-(2-methylprop-1-enyl)ethanimidamide is sourced from PubChem (CID 123265580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).