N-ethyl-N'-methylbenzenecarboximidamide

C10H14N2 — CID 3049211

IUPACN-ethyl-N'-methylbenzenecarboximidamide
SMILESCCN/C(=N\C)c1ccccc1
InChIInChI=1S/C10H14N2/c1-3-12-10(11-2)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,11,12)
InChIKeyXPJYNRPRFVIUIH-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.67
Rot. Bonds2

About N-ethyl-N'-methylbenzenecarboximidamide

N-ethyl-N'-methylbenzenecarboximidamide (PubChem CID 3049211) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-ethyl-N'-methylbenzenecarboximidamide.

Molecular Properties

Compound NameN-ethyl-N'-methylbenzenecarboximidamide
PubChem CID3049211
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-ethyl-N'-methylbenzenecarboximidamide
SMILESCCN/C(=N\C)c1ccccc1
InChIInChI=1S/C10H14N2/c1-3-12-10(11-2)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,11,12)
InChIKeyXPJYNRPRFVIUIH-UHFFFAOYSA-N
XLogP1.67
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.67
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-ethyl-N'-methylbenzenecarboximidamide?
The IUPAC name of N-ethyl-N'-methylbenzenecarboximidamide (CID 3049211) is N-ethyl-N'-methylbenzenecarboximidamide.
What is the SMILES notation for N-ethyl-N'-methylbenzenecarboximidamide?
The canonical SMILES for N-ethyl-N'-methylbenzenecarboximidamide is CCN/C(=N\C)c1ccccc1.
What is the InChIKey of N-ethyl-N'-methylbenzenecarboximidamide?
The InChIKey is XPJYNRPRFVIUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-3-12-10(11-2)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,11,12).
What are the key properties of N-ethyl-N'-methylbenzenecarboximidamide?
N-ethyl-N'-methylbenzenecarboximidamide has a molecular weight of 162.24 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-methylbenzenecarboximidamide is sourced from PubChem (CID 3049211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).