2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide

C15H20N2 — CID 126560090

IUPAC2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide
SMILESC=N/C(=N\C=C(/C)c1ccccc1)C(C)(C)C
InChIInChI=1S/C15H20N2/c1-12(13-9-7-6-8-10-13)11-17-14(16-5)15(2,3)4/h6-11H,5H2,1-4H3/b12-11+,17-14-
InChIKeyIDZDFFHEYISAFP-VPJURZAQSA-N
MW228.34 g/mol
LogP4.19
Rot. Bonds2

About 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide

2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide (PubChem CID 126560090) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide
PubChem CID126560090
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide
SMILESC=N/C(=N\C=C(/C)c1ccccc1)C(C)(C)C
InChIInChI=1S/C15H20N2/c1-12(13-9-7-6-8-10-13)11-17-14(16-5)15(2,3)4/h6-11H,5H2,1-4H3/b12-11+,17-14-
InChIKeyIDZDFFHEYISAFP-VPJURZAQSA-N
XLogP4.19
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

phenyl-[(Z)-2-phenylprop-1-enyl]diazene
CID 102533544
4,4-dimethyl-2-phenylpent-2-en-3-ol
CID 71336376
[(E)-but-2-en-2-yl]benzene;methane;2-methylprop-1-ene
CID 155717398
1-bromoprop-1-en-2-ylbenzene
CID 5152757
[(E)-1-chloroprop-1-en-2-yl]benzene
CID 12504275
1-iodoprop-1-en-2-ylbenzene
CID 54065087
(E)-2,2-difluoro-4-phenylpent-3-en-1-ol
CID 132517262
1-tert-butyl-4-[(E)-2-phenylprop-1-enyl]benzene
CID 156672934
1,1,1-trifluoro-4-phenylpent-3-en-2-ol
CID 54050164
(5-fluoro-2,5-dimethyl-4-methylidenehex-2-en-3-yl)benzene
CID 170149907
methane;methylphosphane;2-phenylprop-1-enylphosphane;prop-1-en-2-ylbenzene
CID 159485123
1-(1-fluoroprop-1-en-2-yl)-4-phenylbenzene
CID 134863084

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide?
The IUPAC name of 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide (CID 126560090) is 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide.
What is the SMILES notation for 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide?
The canonical SMILES for 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide is C=N/C(=N\C=C(/C)c1ccccc1)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide?
The InChIKey is IDZDFFHEYISAFP-VPJURZAQSA-N. The full InChI is InChI=1S/C15H20N2/c1-12(13-9-7-6-8-10-13)11-17-14(16-5)15(2,3)4/h6-11H,5H2,1-4H3/b12-11+,17-14-.
What are the key properties of 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide?
2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide has a molecular weight of 228.34 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-methylidene-N'-[(E)-2-phenylprop-1-enyl]propanimidamide is sourced from PubChem (CID 126560090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).