N-(methoxymethoxy)-3-methylbutanamide

C7H15NO3 — CID 110495435

IUPACN-(methoxymethoxy)-3-methylbutanamide
SMILESCOCONC(=O)CC(C)C
InChIInChI=1S/C7H15NO3/c1-6(2)4-7(9)8-11-5-10-3/h6H,4-5H2,1-3H3,(H,8,9)
InChIKeyNXIQCJMJOVPCJA-UHFFFAOYSA-N
MW161.20 g/mol
LogP0.68
Rot. Bonds5

About N-(methoxymethoxy)-3-methylbutanamide

N-(methoxymethoxy)-3-methylbutanamide (PubChem CID 110495435) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is N-(methoxymethoxy)-3-methylbutanamide.

Molecular Properties

Compound NameN-(methoxymethoxy)-3-methylbutanamide
PubChem CID110495435
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC NameN-(methoxymethoxy)-3-methylbutanamide
SMILESCOCONC(=O)CC(C)C
InChIInChI=1S/C7H15NO3/c1-6(2)4-7(9)8-11-5-10-3/h6H,4-5H2,1-3H3,(H,8,9)
InChIKeyNXIQCJMJOVPCJA-UHFFFAOYSA-N
XLogP0.68
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(methoxymethoxy)-3-methylbutanamide?
The IUPAC name of N-(methoxymethoxy)-3-methylbutanamide (CID 110495435) is N-(methoxymethoxy)-3-methylbutanamide.
What is the SMILES notation for N-(methoxymethoxy)-3-methylbutanamide?
The canonical SMILES for N-(methoxymethoxy)-3-methylbutanamide is COCONC(=O)CC(C)C.
What is the InChIKey of N-(methoxymethoxy)-3-methylbutanamide?
The InChIKey is NXIQCJMJOVPCJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-6(2)4-7(9)8-11-5-10-3/h6H,4-5H2,1-3H3,(H,8,9).
What are the key properties of N-(methoxymethoxy)-3-methylbutanamide?
N-(methoxymethoxy)-3-methylbutanamide has a molecular weight of 161.20 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethoxy)-3-methylbutanamide is sourced from PubChem (CID 110495435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).