N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide

C7H12N2 — CID 123204319

IUPACN'-methyl-N-prop-1-en-2-ylprop-2-enimidamide
SMILESC=C/C(=N\C)NC(=C)C
InChIInChI=1S/C7H12N2/c1-5-7(8-4)9-6(2)3/h5H,1-2H2,3-4H3,(H,8,9)
InChIKeyOYMJOTKLQJZLPC-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.32
Rot. Bonds2

About N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide

N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide (PubChem CID 123204319) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide.

Molecular Properties

Compound NameN'-methyl-N-prop-1-en-2-ylprop-2-enimidamide
PubChem CID123204319
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC NameN'-methyl-N-prop-1-en-2-ylprop-2-enimidamide
SMILESC=C/C(=N\C)NC(=C)C
InChIInChI=1S/C7H12N2/c1-5-7(8-4)9-6(2)3/h5H,1-2H2,3-4H3,(H,8,9)
InChIKeyOYMJOTKLQJZLPC-UHFFFAOYSA-N
XLogP1.32
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.32
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

2,6-Dimethyl-1,4-dihydropyrimidine
CID 57135030
2-methyl-6-methylidene-1H-pyrimidine
CID 57672172
(5Z,7Z)-2-methyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 68220253
(Z)-3-amino-N,N'-dimethylbut-2-enimidamide
CID 90453942
N'-methyl-N-prop-1-en-2-ylethanimidamide
CID 91470690
N'-ethyl-N-[(3Z)-hexa-1,3,5-trien-2-yl]ethanimidamide
CID 121279957
N'-ethyl-N-prop-1-en-2-ylethanimidamide
CID 123768299
(7Z)-2-methyl-9-methylidene-1,4-dihydro-1,3-diazonine
CID 123778633
(Z)-N'-prop-1-en-2-ylbut-2-enimidamide
CID 124005322
(E)-N'-ethyl-N-prop-1-en-2-ylbut-2-enimidamide
CID 124182032
N'-methyl-N-[(2Z)-penta-2,4-dien-2-yl]ethanimidamide
CID 126636618
(Z)-3-amino-N'-prop-2-enylbut-2-enimidamide
CID 129040046

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide?
The IUPAC name of N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide (CID 123204319) is N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide.
What is the SMILES notation for N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide?
The canonical SMILES for N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide is C=C/C(=N\C)NC(=C)C.
What is the InChIKey of N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide?
The InChIKey is OYMJOTKLQJZLPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-5-7(8-4)9-6(2)3/h5H,1-2H2,3-4H3,(H,8,9).
What are the key properties of N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide?
N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide has a molecular weight of 124.19 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-prop-1-en-2-ylprop-2-enimidamide is sourced from PubChem (CID 123204319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).