N'-prop-2-enylprop-2-enimidamide

C6H10N2 — CID 123258044

IUPACN'-prop-2-enylprop-2-enimidamide
SMILESC=CC/N=C(/N)C=C
InChIInChI=1S/C6H10N2/c1-3-5-8-6(7)4-2/h3-4H,1-2,5H2,(H2,7,8)
InChIKeyZPHAAVZLQOXPNF-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.72
Rot. Bonds3

About N'-prop-2-enylprop-2-enimidamide

N'-prop-2-enylprop-2-enimidamide (PubChem CID 123258044) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N'-prop-2-enylprop-2-enimidamide.

Molecular Properties

Compound NameN'-prop-2-enylprop-2-enimidamide
PubChem CID123258044
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN'-prop-2-enylprop-2-enimidamide
SMILESC=CC/N=C(/N)C=C
InChIInChI=1S/C6H10N2/c1-3-5-8-6(7)4-2/h3-4H,1-2,5H2,(H2,7,8)
InChIKeyZPHAAVZLQOXPNF-UHFFFAOYSA-N
XLogP0.72
TPSA38.38 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 ≤ 50.72
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-prop-2-enylprop-2-enimidamide?
The IUPAC name of N'-prop-2-enylprop-2-enimidamide (CID 123258044) is N'-prop-2-enylprop-2-enimidamide.
What is the SMILES notation for N'-prop-2-enylprop-2-enimidamide?
The canonical SMILES for N'-prop-2-enylprop-2-enimidamide is C=CC/N=C(/N)C=C.
What is the InChIKey of N'-prop-2-enylprop-2-enimidamide?
The InChIKey is ZPHAAVZLQOXPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-3-5-8-6(7)4-2/h3-4H,1-2,5H2,(H2,7,8).
What are the key properties of N'-prop-2-enylprop-2-enimidamide?
N'-prop-2-enylprop-2-enimidamide has a molecular weight of 110.16 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-prop-2-enylprop-2-enimidamide is sourced from PubChem (CID 123258044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).