N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide

C11H23NO3 — CID 153358317

IUPACN-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)COC(C)(C)CCO
InChIInChI=1S/C11H23NO3/c1-9(14)12-10(2,3)8-15-11(4,5)6-7-13/h13H,6-8H2,1-5H3,(H,12,14)
InChIKeyDBAFUGXVKOGRIR-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.08
Rot. Bonds6

About N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide

N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide (PubChem CID 153358317) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide.

Molecular Properties

Compound NameN-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide
PubChem CID153358317
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide
SMILESCC(=O)NC(C)(C)COC(C)(C)CCO
InChIInChI=1S/C11H23NO3/c1-9(14)12-10(2,3)8-15-11(4,5)6-7-13/h13H,6-8H2,1-5H3,(H,12,14)
InChIKeyDBAFUGXVKOGRIR-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

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Related Compounds

N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]propanamide
CID 87638559
N-[2-(4-hydroxy-2-methylbutan-2-yl)oxyethyl]acetamide
CID 88884080
N-[1-ethoxy-2-(methoxymethyl)butan-2-yl]acetamide
CID 123909093
N-[1-hydroxy-3-(2-methylbutan-2-yloxy)propan-2-yl]acetamide
CID 134215824
N-(1,3-dihydroxy-2-methylpropan-2-yl)acetamide;ethane
CID 142357368
ethane;N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]acetamide
CID 142869018
ethane;N-[3-(hydroxymethyl)oxetan-3-yl]acetamide
CID 168240268
ethane;N-[1-hydroxy-3-methoxy-2-(methoxymethyl)propan-2-yl]acetamide
CID 176980933
2-ethoxy-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
CID 64555985
N-(1-hydroxy-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
CID 103021107
N-(4-hydroxy-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
CID 103021204
2-ethoxy-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]acetamide
CID 103890820

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide?
The IUPAC name of N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide (CID 153358317) is N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide.
What is the SMILES notation for N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide?
The canonical SMILES for N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide is CC(=O)NC(C)(C)COC(C)(C)CCO.
What is the InChIKey of N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide?
The InChIKey is DBAFUGXVKOGRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-9(14)12-10(2,3)8-15-11(4,5)6-7-13/h13H,6-8H2,1-5H3,(H,12,14).
What are the key properties of N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide?
N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide 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-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide is sourced from PubChem (CID 153358317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).