(Z)-2-methylbut-2-enimidamide

C5H10N2 — CID 123808723

IUPAC(Z)-2-methylbut-2-enimidamide
SMILES[H]/N=C(N)/C(C)=C\C
InChIInChI=1S/C5H10N2/c1-3-4(2)5(6)7/h3H,1-2H3,(H3,6,7)/b4-3-
InChIKeyFUQNRBFUPIQOBE-ARJAWSKDSA-N
MW98.15 g/mol
LogP0.89
Rot. Bonds1

About (Z)-2-methylbut-2-enimidamide

(Z)-2-methylbut-2-enimidamide (PubChem CID 123808723) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is (Z)-2-methylbut-2-enimidamide.

Molecular Properties

Compound Name(Z)-2-methylbut-2-enimidamide
PubChem CID123808723
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name(Z)-2-methylbut-2-enimidamide
SMILES[H]/N=C(N)/C(C)=C\C
InChIInChI=1S/C5H10N2/c1-3-4(2)5(6)7/h3H,1-2H3,(H3,6,7)/b4-3-
InChIKeyFUQNRBFUPIQOBE-ARJAWSKDSA-N
XLogP0.89
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.89
H-Bond Donors ≤ 52
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 (Z)-2-methylbut-2-enimidamide?
The IUPAC name of (Z)-2-methylbut-2-enimidamide (CID 123808723) is (Z)-2-methylbut-2-enimidamide.
What is the SMILES notation for (Z)-2-methylbut-2-enimidamide?
The canonical SMILES for (Z)-2-methylbut-2-enimidamide is [H]/N=C(N)/C(C)=C\C.
What is the InChIKey of (Z)-2-methylbut-2-enimidamide?
The InChIKey is FUQNRBFUPIQOBE-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H10N2/c1-3-4(2)5(6)7/h3H,1-2H3,(H3,6,7)/b4-3-.
What are the key properties of (Z)-2-methylbut-2-enimidamide?
(Z)-2-methylbut-2-enimidamide has a molecular weight of 98.15 g/mol, XLogP of 0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methylbut-2-enimidamide is sourced from PubChem (CID 123808723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).