2-methoxy-N,3-dimethylbutanamide

C7H15NO2 — CID 88902446

IUPAC2-methoxy-N,3-dimethylbutanamide
SMILESCNC(=O)C(OC)C(C)C
InChIInChI=1S/C7H15NO2/c1-5(2)6(10-4)7(9)8-3/h5-6H,1-4H3,(H,8,9)
InChIKeyVCTHVEWNIKUJCO-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.40
Rot. Bonds3

About 2-methoxy-N,3-dimethylbutanamide

2-methoxy-N,3-dimethylbutanamide (PubChem CID 88902446) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-methoxy-N,3-dimethylbutanamide.

Molecular Properties

Compound Name2-methoxy-N,3-dimethylbutanamide
PubChem CID88902446
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-methoxy-N,3-dimethylbutanamide
SMILESCNC(=O)C(OC)C(C)C
InChIInChI=1S/C7H15NO2/c1-5(2)6(10-4)7(9)8-3/h5-6H,1-4H3,(H,8,9)
InChIKeyVCTHVEWNIKUJCO-UHFFFAOYSA-N
XLogP0.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,3-dimethylbutanamide?
The IUPAC name of 2-methoxy-N,3-dimethylbutanamide (CID 88902446) is 2-methoxy-N,3-dimethylbutanamide.
What is the SMILES notation for 2-methoxy-N,3-dimethylbutanamide?
The canonical SMILES for 2-methoxy-N,3-dimethylbutanamide is CNC(=O)C(OC)C(C)C.
What is the InChIKey of 2-methoxy-N,3-dimethylbutanamide?
The InChIKey is VCTHVEWNIKUJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-5(2)6(10-4)7(9)8-3/h5-6H,1-4H3,(H,8,9).
What are the key properties of 2-methoxy-N,3-dimethylbutanamide?
2-methoxy-N,3-dimethylbutanamide has a molecular weight of 145.20 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,3-dimethylbutanamide is sourced from PubChem (CID 88902446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).