N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide

C8H17NO4 — CID 10375287

IUPACN-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide
SMILESCOC(OC)C(=O)NC(C)(C)CO
InChIInChI=1S/C8H17NO4/c1-8(2,5-10)9-6(11)7(12-3)13-4/h7,10H,5H2,1-4H3,(H,9,11)
InChIKeyPOKYSUQLDZOMRX-UHFFFAOYSA-N
MW191.23 g/mol
LogP-0.51
Rot. Bonds5

About N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide

N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide (PubChem CID 10375287) has the molecular formula C8H17NO4 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide
PubChem CID10375287
Molecular FormulaC8H17NO4
Molecular Weight191.23 g/mol
Exact Mass191.12
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide
SMILESCOC(OC)C(=O)NC(C)(C)CO
InChIInChI=1S/C8H17NO4/c1-8(2,5-10)9-6(11)7(12-3)13-4/h7,10H,5H2,1-4H3,(H,9,11)
InChIKeyPOKYSUQLDZOMRX-UHFFFAOYSA-N
XLogP-0.51
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-acetamido-3-hydroxy-2-methylpropoxy)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 130296524
N-tert-butyl-2-[3-(3-hydroxypropoxy)propoxy]acetamide
CID 146339879
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(3-ethoxypropoxy)acetamide
CID 146583095
2-ethoxy-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 12497729
N-(1-hydroxy-2-methylpropan-2-yl)-2-(2-methoxyethoxy)acetamide
CID 43500683
N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-ethoxyacetamide
CID 81964505
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-ethoxyacetamide
CID 85945371
N-(1-hydroxy-2-methylpropan-2-yl)-2-propoxyacetamide
CID 103846128
N-(1,3-dihydroxy-2-methylpropan-2-yl)-2-propoxyacetamide
CID 104920690
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-propoxyacetamide
CID 107939705

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide (CID 10375287) is N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide is COC(OC)C(=O)NC(C)(C)CO.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide?
The InChIKey is POKYSUQLDZOMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO4/c1-8(2,5-10)9-6(11)7(12-3)13-4/h7,10H,5H2,1-4H3,(H,9,11).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide?
N-(1-hydroxy-2-methylpropan-2-yl)-2,2-dimethoxyacetamide has a molecular weight of 191.23 g/mol, XLogP of -0.51, 5 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-dimethoxyacetamide is sourced from PubChem (CID 10375287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).