4-methyl-2-methylidenehexanimidamide

C8H16N2 — CID 137386434

IUPAC4-methyl-2-methylidenehexanimidamide
SMILES[H]/N=C(\N)C(=C)CC(C)CC
InChIInChI=1S/C8H16N2/c1-4-6(2)5-7(3)8(9)10/h6H,3-5H2,1-2H3,(H3,9,10)
InChIKeyIEYBWFKNWQPLNX-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.91
Rot. Bonds4

About 4-methyl-2-methylidenehexanimidamide

4-methyl-2-methylidenehexanimidamide (PubChem CID 137386434) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 4-methyl-2-methylidenehexanimidamide.

Molecular Properties

Compound Name4-methyl-2-methylidenehexanimidamide
PubChem CID137386434
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name4-methyl-2-methylidenehexanimidamide
SMILES[H]/N=C(\N)C(=C)CC(C)CC
InChIInChI=1S/C8H16N2/c1-4-6(2)5-7(3)8(9)10/h6H,3-5H2,1-2H3,(H3,9,10)
InChIKeyIEYBWFKNWQPLNX-UHFFFAOYSA-N
XLogP1.91
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.91
H-Bond Donors ≤ 52
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 4-methyl-2-methylidenehexanimidamide?
The IUPAC name of 4-methyl-2-methylidenehexanimidamide (CID 137386434) is 4-methyl-2-methylidenehexanimidamide.
What is the SMILES notation for 4-methyl-2-methylidenehexanimidamide?
The canonical SMILES for 4-methyl-2-methylidenehexanimidamide is [H]/N=C(\N)C(=C)CC(C)CC.
What is the InChIKey of 4-methyl-2-methylidenehexanimidamide?
The InChIKey is IEYBWFKNWQPLNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-6(2)5-7(3)8(9)10/h6H,3-5H2,1-2H3,(H3,9,10).
What are the key properties of 4-methyl-2-methylidenehexanimidamide?
4-methyl-2-methylidenehexanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-methylidenehexanimidamide is sourced from PubChem (CID 137386434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).