(E)-3-ethyl-N',5-dimethylhex-2-enimidamide

C10H20N2 — CID 142528584

IUPAC(E)-3-ethyl-N',5-dimethylhex-2-enimidamide
SMILESCC/C(=C\C(N)=N\C)CC(C)C
InChIInChI=1S/C10H20N2/c1-5-9(6-8(2)3)7-10(11)12-4/h7-8H,5-6H2,1-4H3,(H2,11,12)/b9-7+
InChIKeyBOTPYTOFZIQVRP-VQHVLOKHSA-N
MW168.28 g/mol
LogP2.36
Rot. Bonds4

About (E)-3-ethyl-N',5-dimethylhex-2-enimidamide

(E)-3-ethyl-N',5-dimethylhex-2-enimidamide (PubChem CID 142528584) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (E)-3-ethyl-N',5-dimethylhex-2-enimidamide.

Molecular Properties

Compound Name(E)-3-ethyl-N',5-dimethylhex-2-enimidamide
PubChem CID142528584
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(E)-3-ethyl-N',5-dimethylhex-2-enimidamide
SMILESCC/C(=C\C(N)=N\C)CC(C)C
InChIInChI=1S/C10H20N2/c1-5-9(6-8(2)3)7-10(11)12-4/h7-8H,5-6H2,1-4H3,(H2,11,12)/b9-7+
InChIKeyBOTPYTOFZIQVRP-VQHVLOKHSA-N
XLogP2.36
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.36
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'}

Analyze (E)-3-ethyl-N',5-dimethylhex-2-enimidamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-3-ethyl-N',5-dimethylhex-2-enimidamide?
The IUPAC name of (E)-3-ethyl-N',5-dimethylhex-2-enimidamide (CID 142528584) is (E)-3-ethyl-N',5-dimethylhex-2-enimidamide.
What is the SMILES notation for (E)-3-ethyl-N',5-dimethylhex-2-enimidamide?
The canonical SMILES for (E)-3-ethyl-N',5-dimethylhex-2-enimidamide is CC/C(=C\C(N)=N\C)CC(C)C.
What is the InChIKey of (E)-3-ethyl-N',5-dimethylhex-2-enimidamide?
The InChIKey is BOTPYTOFZIQVRP-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H20N2/c1-5-9(6-8(2)3)7-10(11)12-4/h7-8H,5-6H2,1-4H3,(H2,11,12)/b9-7+.
What are the key properties of (E)-3-ethyl-N',5-dimethylhex-2-enimidamide?
(E)-3-ethyl-N',5-dimethylhex-2-enimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-ethyl-N',5-dimethylhex-2-enimidamide is sourced from PubChem (CID 142528584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).