6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole

C14H24N4O — CID 67763538

IUPAC6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole
SMILESC=Cc1ncc[nH]1.CC(=CCCCN(C)C)C(N)=O
InChIInChI=1S/C9H18N2O.C5H6N2/c1-8(9(10)12)6-4-5-7-11(2)3;1-2-5-6-3-4-7-5/h6H,4-5,7H2,1-3H3,(H2,10,12);2-4H,1H2,(H,6,7)
InChIKeyHCWGIUZHSGUHOC-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.81
Rot. Bonds6

About 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole

6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole (PubChem CID 67763538) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole.

Molecular Properties

Compound Name6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole
PubChem CID67763538
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole
SMILESC=Cc1ncc[nH]1.CC(=CCCCN(C)C)C(N)=O
InChIInChI=1S/C9H18N2O.C5H6N2/c1-8(9(10)12)6-4-5-7-11(2)3;1-2-5-6-3-4-7-5/h6H,4-5,7H2,1-3H3,(H2,10,12);2-4H,1H2,(H,6,7)
InChIKeyHCWGIUZHSGUHOC-UHFFFAOYSA-N
XLogP1.81
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole?
The IUPAC name of 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole (CID 67763538) is 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole.
What is the SMILES notation for 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole?
The canonical SMILES for 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole is C=Cc1ncc[nH]1.CC(=CCCCN(C)C)C(N)=O.
What is the InChIKey of 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole?
The InChIKey is HCWGIUZHSGUHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.C5H6N2/c1-8(9(10)12)6-4-5-7-11(2)3;1-2-5-6-3-4-7-5/h6H,4-5,7H2,1-3H3,(H2,10,12);2-4H,1H2,(H,6,7).
What are the key properties of 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole?
6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole has a molecular weight of 264.37 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-2-methylhex-2-enamide;2-ethenyl-1H-imidazole is sourced from PubChem (CID 67763538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).