2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide

C11H15NO3 — CID 19856163

IUPAC2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide
SMILESCc1cc(O)cc(OCC(=O)N(C)C)c1
InChIInChI=1S/C11H15NO3/c1-8-4-9(13)6-10(5-8)15-7-11(14)12(2)3/h4-6,13H,7H2,1-3H3
InChIKeyHOQTWYHGNQUMPO-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.17
Rot. Bonds3

About 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide

2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide (PubChem CID 19856163) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide
PubChem CID19856163
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide
SMILESCc1cc(O)cc(OCC(=O)N(C)C)c1
InChIInChI=1S/C11H15NO3/c1-8-4-9(13)6-10(5-8)15-7-11(14)12(2)3/h4-6,13H,7H2,1-3H3
InChIKeyHOQTWYHGNQUMPO-UHFFFAOYSA-N
XLogP1.17
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-(3-hydroxy-5-methylphenoxy)acetate
CID 90066634
N-cyclopropyl-2-(3,5-dimethylphenoxy)-N-methylacetamide
CID 60749452
N-(cyanomethyl)-2-(3-hydroxy-5-methylphenoxy)acetamide
CID 107679875
2-(3-hydroxy-5-methylphenoxy)-N-phenylacetamide
CID 107679862
2-[3,5-bis(trifluoromethyl)phenoxy]-N,N-dimethylacetamide
CID 78760649
N-butan-2-yl-2-(3-hydroxy-5-methylphenoxy)acetamide
CID 107680226
N-(4-aminophenyl)-2-(3,5-dimethylphenoxy)-N-methylacetamide
CID 43376460
2-(3-fluoro-4-methylphenoxy)-N,N-dimethylacetamide
CID 107171377
3-(3,3-dimethylbutoxy)-5-methylphenol
CID 107679623
3-methyl-5-prop-2-ynoxyphenol
CID 87477485
N-(3-fluorophenyl)-2-(3-hydroxy-5-methylphenoxy)acetamide
CID 107679675
2-(3-hydroxy-5-methylphenoxy)-N-(2-methoxyphenyl)acetamide
CID 107680223

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide?
The IUPAC name of 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide (CID 19856163) is 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide?
The canonical SMILES for 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide is Cc1cc(O)cc(OCC(=O)N(C)C)c1.
What is the InChIKey of 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide?
The InChIKey is HOQTWYHGNQUMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-8-4-9(13)6-10(5-8)15-7-11(14)12(2)3/h4-6,13H,7H2,1-3H3.
What are the key properties of 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide?
2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide has a molecular weight of 209.24 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-5-methylphenoxy)-N,N-dimethylacetamide is sourced from PubChem (CID 19856163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).