2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide

C17H19NO2 — CID 107735699

IUPAC2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
SMILESCc1ccc(C)c(CC(=O)N(C)c2cccc(O)c2)c1
InChIInChI=1S/C17H19NO2/c1-12-7-8-13(2)14(9-12)10-17(20)18(3)15-5-4-6-16(19)11-15/h4-9,11,19H,10H2,1-3H3
InChIKeyLOXCGDSXQNHTJR-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.21
Rot. Bonds3

About 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide

2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide (PubChem CID 107735699) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
PubChem CID107735699
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
SMILESCc1ccc(C)c(CC(=O)N(C)c2cccc(O)c2)c1
InChIInChI=1S/C17H19NO2/c1-12-7-8-13(2)14(9-12)10-17(20)18(3)15-5-4-6-16(19)11-15/h4-9,11,19H,10H2,1-3H3
InChIKeyLOXCGDSXQNHTJR-UHFFFAOYSA-N
XLogP3.21
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dimethylphenyl)-N-(4-hydroxyphenyl)-N-methylacetamide
CID 62539015
N-[3-(aminomethyl)phenyl]-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 62971832
2-(2,5-dimethylphenyl)-N-[1-(3-hydroxyphenyl)ethyl]-N-methylacetamide
CID 71859784
2-(2,3-difluorophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735720
N-(4-cyanophenyl)-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 62981903
2-(2,4-dimethylphenyl)-N-methyl-N-phenylacetamide
CID 100585469
2-(2,5-dimethylphenyl)-N-methylacetohydrazide
CID 116844756
2-(3-bromophenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735949
N-(3-hydroxyphenyl)-N-methylpentanamide
CID 107735913
2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)acetamide
CID 55087243
ethyl 4-(3-hydroxy-N-methylanilino)-4-oxobutanoate
CID 107734000
(3-hydroxyphenyl)-methylcarbamic acid
CID 20544632

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide (CID 107735699) is 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide is Cc1ccc(C)c(CC(=O)N(C)c2cccc(O)c2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
The InChIKey is LOXCGDSXQNHTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12-7-8-13(2)14(9-12)10-17(20)18(3)15-5-4-6-16(19)11-15/h4-9,11,19H,10H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide?
2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide has a molecular weight of 269.34 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 107735699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).