N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide

C9H19NO4 — CID 43500683

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NC(C)(C)CO
InChIInChI=1S/C9H19NO4/c1-9(2,7-11)10-8(12)6-14-5-4-13-3/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyGZMWNOKXDRNEPI-UHFFFAOYSA-N
MW205.25 g/mol
LogP-0.46
Rot. Bonds7

About N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide

N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide (PubChem CID 43500683) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide
PubChem CID43500683
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)NC(C)(C)CO
InChIInChI=1S/C9H19NO4/c1-9(2,7-11)10-8(12)6-14-5-4-13-3/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyGZMWNOKXDRNEPI-UHFFFAOYSA-N
XLogP-0.46
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide (CID 43500683) is N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)NC(C)(C)CO.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide?
The InChIKey is GZMWNOKXDRNEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-9(2,7-11)10-8(12)6-14-5-4-13-3/h11H,4-7H2,1-3H3,(H,10,12).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide?
N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide has a molecular weight of 205.25 g/mol, XLogP of -0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 43500683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).