1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone

C16H17NO2 — CID 18330797

IUPAC1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone
SMILESCN(C)c1ccccc1C(=O)C(O)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-17(2)14-11-7-6-10-13(14)16(19)15(18)12-8-4-3-5-9-12/h3-11,15,18H,1-2H3
InChIKeyWVTSQCDTEHQBLF-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.67
Rot. Bonds4

About 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone

1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone (PubChem CID 18330797) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone.

Molecular Properties

Compound Name1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone
PubChem CID18330797
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone
SMILESCN(C)c1ccccc1C(=O)C(O)c1ccccc1
InChIInChI=1S/C16H17NO2/c1-17(2)14-11-7-6-10-13(14)16(19)15(18)12-8-4-3-5-9-12/h3-11,15,18H,1-2H3
InChIKeyWVTSQCDTEHQBLF-UHFFFAOYSA-N
XLogP2.67
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[2-(dimethylamino)phenyl]phenyl]-2-hydroxy-2-phenylethanone
CID 67695568
2-hydroxy-1-[2-(methylamino)phenyl]-2-phenylethanone
CID 67016946
2-(dimethylamino)benzoic acid;ethene
CID 157119009
2-[2-(2-hydroxy-2-phenylacetyl)phenyl]acetic acid
CID 69479306
1-(2-ethoxyphenyl)-2-hydroxy-2-phenylethanone
CID 22096604
2-hydroxy-2-phenyl-1-[2-(1-phenylethoxy)phenyl]ethanone
CID 175347432
1-(2,3-dichlorophenyl)-2-hydroxy-2-phenylethanone
CID 21163872
2-hydroxy-1,2-diphenylethanone
CID 159399559
1-(2-fluoro-3-methoxyphenyl)-2-hydroxy-2-phenylethanone
CID 103458248
2-hydroxy-1-(2-phenacylphenyl)-2-phenylethanone
CID 69188181
5-(2-hydroxy-2-phenylacetyl)benzene-1,2,3,4-tetracarboxylic acid
CID 151883431
2-(dimethylamino)benzoic acid;2-methylprop-2-enoic acid
CID 146636076

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone?
The IUPAC name of 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone (CID 18330797) is 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone.
What is the SMILES notation for 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone?
The canonical SMILES for 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone is CN(C)c1ccccc1C(=O)C(O)c1ccccc1.
What is the InChIKey of 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone?
The InChIKey is WVTSQCDTEHQBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-17(2)14-11-7-6-10-13(14)16(19)15(18)12-8-4-3-5-9-12/h3-11,15,18H,1-2H3.
What are the key properties of 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone?
1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone has a molecular weight of 255.32 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)phenyl]-2-hydroxy-2-phenylethanone is sourced from PubChem (CID 18330797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).