N,N'-dimethylprop-2-enimidamide

C5H10N2 — CID 58478000

IUPACN,N'-dimethylprop-2-enimidamide
SMILESC=C/C(=N\C)NC
InChIInChI=1S/C5H10N2/c1-4-5(6-2)7-3/h4H,1H2,2-3H3,(H,6,7)
InChIKeyBSZHQLNGHIUBOP-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.42
Rot. Bonds1

About N,N'-dimethylprop-2-enimidamide

N,N'-dimethylprop-2-enimidamide (PubChem CID 58478000) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N,N'-dimethylprop-2-enimidamide.

Molecular Properties

Compound NameN,N'-dimethylprop-2-enimidamide
PubChem CID58478000
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN,N'-dimethylprop-2-enimidamide
SMILESC=C/C(=N\C)NC
InChIInChI=1S/C5H10N2/c1-4-5(6-2)7-3/h4H,1H2,2-3H3,(H,6,7)
InChIKeyBSZHQLNGHIUBOP-UHFFFAOYSA-N
XLogP0.42
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.42
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,N'-dimethylprop-2-enimidamide?
The IUPAC name of N,N'-dimethylprop-2-enimidamide (CID 58478000) is N,N'-dimethylprop-2-enimidamide.
What is the SMILES notation for N,N'-dimethylprop-2-enimidamide?
The canonical SMILES for N,N'-dimethylprop-2-enimidamide is C=C/C(=N\C)NC.
What is the InChIKey of N,N'-dimethylprop-2-enimidamide?
The InChIKey is BSZHQLNGHIUBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-4-5(6-2)7-3/h4H,1H2,2-3H3,(H,6,7).
What are the key properties of N,N'-dimethylprop-2-enimidamide?
N,N'-dimethylprop-2-enimidamide has a molecular weight of 98.15 g/mol, XLogP of 0.42, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethylprop-2-enimidamide is sourced from PubChem (CID 58478000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).