2-methoxy-N-propan-2-ylacetamide

C6H13NO2 — CID 19353620

IUPAC2-methoxy-N-propan-2-ylacetamide
SMILESCOCC(=O)NC(C)C
InChIInChI=1S/C6H13NO2/c1-5(2)7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyDJALWYUGTGGHDC-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.16
Rot. Bonds3

About 2-methoxy-N-propan-2-ylacetamide

2-methoxy-N-propan-2-ylacetamide (PubChem CID 19353620) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is 2-methoxy-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-methoxy-N-propan-2-ylacetamide
PubChem CID19353620
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name2-methoxy-N-propan-2-ylacetamide
SMILESCOCC(=O)NC(C)C
InChIInChI=1S/C6H13NO2/c1-5(2)7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyDJALWYUGTGGHDC-UHFFFAOYSA-N
XLogP0.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-propan-2-ylacetamide?
The IUPAC name of 2-methoxy-N-propan-2-ylacetamide (CID 19353620) is 2-methoxy-N-propan-2-ylacetamide.
What is the SMILES notation for 2-methoxy-N-propan-2-ylacetamide?
The canonical SMILES for 2-methoxy-N-propan-2-ylacetamide is COCC(=O)NC(C)C.
What is the InChIKey of 2-methoxy-N-propan-2-ylacetamide?
The InChIKey is DJALWYUGTGGHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-5(2)7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8).
What are the key properties of 2-methoxy-N-propan-2-ylacetamide?
2-methoxy-N-propan-2-ylacetamide has a molecular weight of 131.18 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-propan-2-ylacetamide is sourced from PubChem (CID 19353620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).