2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide

C9H19NO3 — CID 64555985

IUPAC2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCCOCC(=O)NC(C)(CC)CO
InChIInChI=1S/C9H19NO3/c1-4-9(3,7-11)10-8(12)6-13-5-2/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyMQSDRLPAOUETGO-UHFFFAOYSA-N
MW189.25 g/mol
LogP0.30
Rot. Bonds6

About 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide

2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide (PubChem CID 64555985) has the molecular formula C9H19NO3 and a molecular weight of 189.25 g/mol. Its IUPAC name is 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
PubChem CID64555985
Molecular FormulaC9H19NO3
Molecular Weight189.25 g/mol
Exact Mass189.14
IUPAC Name2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCCOCC(=O)NC(C)(CC)CO
InChIInChI=1S/C9H19NO3/c1-4-9(3,7-11)10-8(12)6-13-5-2/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyMQSDRLPAOUETGO-UHFFFAOYSA-N
XLogP0.30
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.25
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide (CID 64555985) is 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide is CCOCC(=O)NC(C)(CC)CO.
What is the InChIKey of 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The InChIKey is MQSDRLPAOUETGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3/c1-4-9(3,7-11)10-8(12)6-13-5-2/h11H,4-7H2,1-3H3,(H,10,12).
What are the key properties of 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide has a molecular weight of 189.25 g/mol, XLogP of 0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 64555985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).