N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide

C6H10N2 — CID 91073918

IUPACN-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide
SMILESC=CN/C=N/C=C/C
InChIInChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h3-6H,2H2,1H3,(H,7,8)/b5-3+
InChIKeySNFISBXZNILWQG-HWKANZROSA-N
MW110.16 g/mol
LogP1.28
Rot. Bonds3

About N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide

N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide (PubChem CID 91073918) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide.

Molecular Properties

Compound NameN-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide
PubChem CID91073918
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide
SMILESC=CN/C=N/C=C/C
InChIInChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h3-6H,2H2,1H3,(H,7,8)/b5-3+
InChIKeySNFISBXZNILWQG-HWKANZROSA-N
XLogP1.28
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.28
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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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide?
The IUPAC name of N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide (CID 91073918) is N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide.
What is the SMILES notation for N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide?
The canonical SMILES for N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide is C=CN/C=N/C=C/C.
What is the InChIKey of N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide?
The InChIKey is SNFISBXZNILWQG-HWKANZROSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-5-8-6-7-4-2/h3-6H,2H2,1H3,(H,7,8)/b5-3+.
What are the key properties of N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide?
N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide has a molecular weight of 110.16 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-[(E)-prop-1-enyl]methanimidamide is sourced from PubChem (CID 91073918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).