4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide

C11H24N2O2 — CID 166075571

IUPAC4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide
SMILESCOCCNC(=O)C(C)(C)CCN(C)C
InChIInChI=1S/C11H24N2O2/c1-11(2,6-8-13(3)4)10(14)12-7-9-15-5/h6-9H2,1-5H3,(H,12,14)
InChIKeyBWLNHZNVSLWCMM-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.73
Rot. Bonds7

About 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide

4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide (PubChem CID 166075571) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide
PubChem CID166075571
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide
SMILESCOCCNC(=O)C(C)(C)CCN(C)C
InChIInChI=1S/C11H24N2O2/c1-11(2,6-8-13(3)4)10(14)12-7-9-15-5/h6-9H2,1-5H3,(H,12,14)
InChIKeyBWLNHZNVSLWCMM-UHFFFAOYSA-N
XLogP0.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide?
The IUPAC name of 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide (CID 166075571) is 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide is COCCNC(=O)C(C)(C)CCN(C)C.
What is the InChIKey of 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide?
The InChIKey is BWLNHZNVSLWCMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(2,6-8-13(3)4)10(14)12-7-9-15-5/h6-9H2,1-5H3,(H,12,14).
What are the key properties of 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide?
4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide has a molecular weight of 216.32 g/mol, XLogP of 0.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-methoxyethyl)-2,2-dimethylbutanamide is sourced from PubChem (CID 166075571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).