2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone

C10H13NO2 — CID 546921

IUPAC2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone
SMILESCN(C)CC(=O)c1ccccc1O
InChIInChI=1S/C10H13NO2/c1-11(2)7-10(13)8-5-3-4-6-9(8)12/h3-6,12H,7H2,1-2H3
InChIKeyMHWBYNOGVODENP-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.14
Rot. Bonds3

About 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone

2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone (PubChem CID 546921) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone
PubChem CID546921
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone
SMILESCN(C)CC(=O)c1ccccc1O
InChIInChI=1S/C10H13NO2/c1-11(2)7-10(13)8-5-3-4-6-9(8)12/h3-6,12H,7H2,1-2H3
InChIKeyMHWBYNOGVODENP-UHFFFAOYSA-N
XLogP1.14
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone?
The IUPAC name of 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone (CID 546921) is 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone.
What is the SMILES notation for 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone?
The canonical SMILES for 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone is CN(C)CC(=O)c1ccccc1O.
What is the InChIKey of 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone?
The InChIKey is MHWBYNOGVODENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-11(2)7-10(13)8-5-3-4-6-9(8)12/h3-6,12H,7H2,1-2H3.
What are the key properties of 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone?
2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone has a molecular weight of 179.22 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(2-hydroxyphenyl)ethanone is sourced from PubChem (CID 546921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).