N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide

C11H23NO3 — CID 103933314

IUPACN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide
SMILESCCCOCC(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H23NO3/c1-6-7-15-8-9(13)12-10(2,3)11(4,5)14/h14H,6-8H2,1-5H3,(H,12,13)
InChIKeyAUAQOBQCDDBFRF-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.08
Rot. Bonds6

About N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide (PubChem CID 103933314) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide
PubChem CID103933314
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide
SMILESCCCOCC(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H23NO3/c1-6-7-15-8-9(13)12-10(2,3)11(4,5)14/h14H,6-8H2,1-5H3,(H,12,13)
InChIKeyAUAQOBQCDDBFRF-UHFFFAOYSA-N
XLogP1.08
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-propoxyacetamide
CID 107940494
N-(2-hydroxy-2-methylpentyl)-2-propoxyacetamide
CID 103713311
2-[(2-butoxyacetyl)amino]-2-methylpropanoic acid
CID 119187574
N-(2-methylbutan-2-yl)-2-[2-(propylamino)ethoxy]acetamide
CID 62335943
N-(2-bromoethyl)-2-propoxyacetamide
CID 107941217
2-(2-propoxyethoxy)-N-propylacetamide
CID 149463198
N-(3-amino-2,2-dimethyl-3-sulfanylidenepropyl)-2-propoxyacetamide
CID 107939067
2-[2-(methylamino)ethoxy]-N-(2-methylbutan-2-yl)acetamide
CID 62338179
N-tert-butyl-2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]acetamide
CID 146605936
N-(1-bromo-2-methylpropan-2-yl)-2-ethoxyacetamide
CID 114308041
2-[[2-(2-aminoethoxy)acetyl]amino]-2-methylpentanoic acid
CID 79473096
2-butoxy-N-[1-(2-methylpropoxy)-2-(2-methylpropoxymethyl)-3-propoxypropan-2-yl]acetamide
CID 167448031

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide?
The IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide (CID 103933314) is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide.
What is the SMILES notation for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide?
The canonical SMILES for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide is CCCOCC(=O)NC(C)(C)C(C)(C)O.
What is the InChIKey of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide?
The InChIKey is AUAQOBQCDDBFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-6-7-15-8-9(13)12-10(2,3)11(4,5)14/h14H,6-8H2,1-5H3,(H,12,13).
What are the key properties of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide?
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide has a molecular weight of 217.31 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-propoxyacetamide is sourced from PubChem (CID 103933314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).