N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide

C9H18N2 — CID 143488870

IUPACN-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide
SMILESC=C(C)/N=C(\CC)N(C)CC
InChIInChI=1S/C9H18N2/c1-6-9(10-8(3)4)11(5)7-2/h3,6-7H2,1-2,4-5H3/b10-9+
InChIKeySQSXYBYVZRGROE-MDZDMXLPSA-N
MW154.26 g/mol
LogP2.28
Rot. Bonds3

About N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide

N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide (PubChem CID 143488870) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide
PubChem CID143488870
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide
SMILESC=C(C)/N=C(\CC)N(C)CC
InChIInChI=1S/C9H18N2/c1-6-9(10-8(3)4)11(5)7-2/h3,6-7H2,1-2,4-5H3/b10-9+
InChIKeySQSXYBYVZRGROE-MDZDMXLPSA-N
XLogP2.28
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.28
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 N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide 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

N-ethyl-2-fluoro-N-methyl-N'-prop-1-en-2-ylpropanimidamide
CID 169915803
1,1,2,5-Tetramethylimidazol-1-ium
CID 67204801
1,1,2,4-Tetraethylimidazol-1-ium
CID 67303699
2-ethyl-1-methyl-5-methylidene-4H-imidazole
CID 67476715
N-methyl-N-pent-4-enyl-N'-prop-1-en-2-ylethanimidamide
CID 89192495
N-ethenyl-N'-methyl-N-propylpropanimidamide
CID 90299348
N-ethenyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide
CID 118612599
(E)-3-(dimethylamino)-N-methyl-N,N'-bis(2-methylpropyl)but-2-enimidamide
CID 121313174
1-Butyl-1,2,4-trimethylimidazol-1-ium
CID 122699323
N,N',2-trimethyl-N-prop-1-en-2-ylpropanimidamide
CID 123338851
N'-methyl-N-propan-2-yl-N-prop-1-en-2-ylethanimidamide
CID 123367208
N-butyl-N-ethyl-N'-prop-1-en-2-ylpropanimidamide
CID 123520006

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide?
The IUPAC name of N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide (CID 143488870) is N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide.
What is the SMILES notation for N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide?
The canonical SMILES for N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide is C=C(C)/N=C(\CC)N(C)CC.
What is the InChIKey of N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide?
The InChIKey is SQSXYBYVZRGROE-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H18N2/c1-6-9(10-8(3)4)11(5)7-2/h3,6-7H2,1-2,4-5H3/b10-9+.
What are the key properties of N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide?
N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide has a molecular weight of 154.26 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-N'-prop-1-en-2-ylpropanimidamide is sourced from PubChem (CID 143488870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).