2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide

C15H13F2NO2 — CID 107735720

IUPAC2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(C(=O)Cc1cccc(F)c1F)c1cccc(O)c1
InChIInChI=1S/C15H13F2NO2/c1-18(11-5-3-6-12(19)9-11)14(20)8-10-4-2-7-13(16)15(10)17/h2-7,9,19H,8H2,1H3
InChIKeyGTSWRHQNDGKGRI-UHFFFAOYSA-N
MW277.27 g/mol
LogP2.88
Rot. Bonds3

About 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide

2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide (PubChem CID 107735720) has the molecular formula C15H13F2NO2 and a molecular weight of 277.27 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
PubChem CID107735720
Molecular FormulaC15H13F2NO2
Molecular Weight277.27 g/mol
Exact Mass277.09
IUPAC Name2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
SMILESCN(C(=O)Cc1cccc(F)c1F)c1cccc(O)c1
InChIInChI=1S/C15H13F2NO2/c1-18(11-5-3-6-12(19)9-11)14(20)8-10-4-2-7-13(16)15(10)17/h2-7,9,19H,8H2,1H3
InChIKeyGTSWRHQNDGKGRI-UHFFFAOYSA-N
XLogP2.88
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735699
2-(3-bromophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735949
N-(3-hydroxyphenyl)-N-methylpentanamide
CID 107735913
(3-hydroxyphenyl)-methylcarbamic acid
CID 20544632
2-fluoro-4-hydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735649
N-(3-hydroxyphenyl)-N,4-dimethylpentanamide
CID 107735895
N-(3-hydroxyphenyl)-N-methylnonanamide
CID 107736082
3,4-difluoro-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107735801
2-(1-aminocyclobutyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107734828
2-[2-(aminomethyl)phenoxy]-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107733334
3-amino-N-(3-hydroxyphenyl)-N-methylpentanamide
CID 107734648
ethyl 4-(3-hydroxy-N-methylanilino)-4-oxobutanoate
CID 107734000

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide (CID 107735720) is 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide is CN(C(=O)Cc1cccc(F)c1F)c1cccc(O)c1.
What is the InChIKey of 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The InChIKey is GTSWRHQNDGKGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c1-18(11-5-3-6-12(19)9-11)14(20)8-10-4-2-7-13(16)15(10)17/h2-7,9,19H,8H2,1H3.
What are the key properties of 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide has a molecular weight of 277.27 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 107735720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).