2-methoxy-N-propan-2-yloxyacetamide

C6H13NO3 — CID 126991751

IUPAC2-methoxy-N-propan-2-yloxyacetamide
SMILESCOCC(=O)NOC(C)C
InChIInChI=1S/C6H13NO3/c1-5(2)10-7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyMPSJIGNGWZMTSS-UHFFFAOYSA-N
MW147.17 g/mol
LogP0.09
Rot. Bonds4

About 2-methoxy-N-propan-2-yloxyacetamide

2-methoxy-N-propan-2-yloxyacetamide (PubChem CID 126991751) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is 2-methoxy-N-propan-2-yloxyacetamide.

Molecular Properties

Compound Name2-methoxy-N-propan-2-yloxyacetamide
PubChem CID126991751
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name2-methoxy-N-propan-2-yloxyacetamide
SMILESCOCC(=O)NOC(C)C
InChIInChI=1S/C6H13NO3/c1-5(2)10-7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyMPSJIGNGWZMTSS-UHFFFAOYSA-N
XLogP0.09
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-propan-2-yloxyacetamide?
The IUPAC name of 2-methoxy-N-propan-2-yloxyacetamide (CID 126991751) is 2-methoxy-N-propan-2-yloxyacetamide.
What is the SMILES notation for 2-methoxy-N-propan-2-yloxyacetamide?
The canonical SMILES for 2-methoxy-N-propan-2-yloxyacetamide is COCC(=O)NOC(C)C.
What is the InChIKey of 2-methoxy-N-propan-2-yloxyacetamide?
The InChIKey is MPSJIGNGWZMTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-5(2)10-7-6(8)4-9-3/h5H,4H2,1-3H3,(H,7,8).
What are the key properties of 2-methoxy-N-propan-2-yloxyacetamide?
2-methoxy-N-propan-2-yloxyacetamide has a molecular weight of 147.17 g/mol, XLogP of 0.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-propan-2-yloxyacetamide is sourced from PubChem (CID 126991751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).