2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide

C13H17NO3 — CID 80717573

IUPAC2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide
SMILESCN(C(=O)Cc1ccccc1O)C1CCOC1
InChIInChI=1S/C13H17NO3/c1-14(11-6-7-17-9-11)13(16)8-10-4-2-3-5-12(10)15/h2-5,11,15H,6-9H2,1H3
InChIKeyMXPOZMVWODVTTE-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.18
Rot. Bonds3

About 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide

2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide (PubChem CID 80717573) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide
PubChem CID80717573
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide
SMILESCN(C(=O)Cc1ccccc1O)C1CCOC1
InChIInChI=1S/C13H17NO3/c1-14(11-6-7-17-9-11)13(16)8-10-4-2-3-5-12(10)15/h2-5,11,15H,6-9H2,1H3
InChIKeyMXPOZMVWODVTTE-UHFFFAOYSA-N
XLogP1.18
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[methyl(oxolan-3-yl)amino]-2-oxoethyl]benzoic acid
CID 104601736
N-methyl-N-(oxolan-3-yl)-2-(5-sulfamoylthiophen-2-yl)acetamide
CID 78947872
5-[methyl(oxolan-3-yl)amino]-5-oxopentanoic acid
CID 82732881
3-amino-N-methyl-N-(oxolan-3-yl)-3-sulfanylidenepropanamide
CID 82738625
4-amino-N-methyl-N-(oxolan-3-yl)-4-phenylbutanamide
CID 81489574
3-(2-aminophenoxy)-N-methyl-N-(oxolan-3-yl)propanamide
CID 82740805
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(oxolan-3-yl)acetamide
CID 82738126
2-bromo-N-methyl-N-(oxolan-3-yl)benzamide
CID 78954018
4-methyl-2-[[methyl(oxolan-3-yl)amino]methyl]phenol
CID 82983002
2-methyl-3-[methyl(oxolan-3-yl)amino]-1-phenylpropan-1-one
CID 82743357
3-(3-aminophenyl)-N-methyl-N-(oxolan-3-yl)propanamide
CID 82740888
2-(3-aminopyrazol-1-yl)-N-methyl-N-(oxolan-3-yl)acetamide
CID 82741366

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide (CID 80717573) is 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide is CN(C(=O)Cc1ccccc1O)C1CCOC1.
What is the InChIKey of 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide?
The InChIKey is MXPOZMVWODVTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-14(11-6-7-17-9-11)13(16)8-10-4-2-3-5-12(10)15/h2-5,11,15H,6-9H2,1H3.
What are the key properties of 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide?
2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide has a molecular weight of 235.28 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-N-methyl-N-(oxolan-3-yl)acetamide is sourced from PubChem (CID 80717573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).