N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide

C18H21NO2 — CID 61043693

IUPACN-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)N(C)C(C)c2ccccc2O)cc1
InChIInChI=1S/C18H21NO2/c1-13-8-10-15(11-9-13)12-18(21)19(3)14(2)16-6-4-5-7-17(16)20/h4-11,14,20H,12H2,1-3H3
InChIKeyHYOYYRNLNILXDA-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.46
Rot. Bonds4

About N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide

N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide (PubChem CID 61043693) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide
PubChem CID61043693
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)N(C)C(C)c2ccccc2O)cc1
InChIInChI=1S/C18H21NO2/c1-13-8-10-15(11-9-13)12-18(21)19(3)14(2)16-6-4-5-7-17(16)20/h4-11,14,20H,12H2,1-3H3
InChIKeyHYOYYRNLNILXDA-UHFFFAOYSA-N
XLogP3.46
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-thiophen-2-ylacetamide
CID 54913397
2-(4-aminophenyl)-N-[1-(2-chlorophenyl)ethyl]-N-methylacetamide
CID 60939540
N-[1-(2-hydroxyphenyl)ethyl]-N-methylpentanamide
CID 54916026
2-(4-hydroxyphenyl)-N-methyl-N-(1-phenylethyl)acetamide
CID 78809223
4-amino-N-[1-(2-hydroxyphenyl)ethyl]-N,3-dimethylbutanamide
CID 81087863
3-ethoxy-N-[1-(2-hydroxyphenyl)ethyl]-N-methylpropanamide
CID 62590459
2-(3,4-dimethoxyphenyl)-N-[1-(2-methoxyphenyl)ethyl]-N-methylacetamide
CID 75871944
N,N-dimethyl-2-(4-methylphenyl)acetamide
CID 4048798
4-(chloromethyl)-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 60949375
N-[1-(2-chlorophenyl)ethyl]-2-(3-hydroxyphenyl)-N-methylacetamide
CID 62729336
methyl N-[1-(2-hydroxyphenyl)ethyl]-N-methylcarbamate
CID 61044422
2-hydroxy-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61042835

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide (CID 61043693) is N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)N(C)C(C)c2ccccc2O)cc1.
What is the InChIKey of N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide?
The InChIKey is HYOYYRNLNILXDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-13-8-10-15(11-9-13)12-18(21)19(3)14(2)16-6-4-5-7-17(16)20/h4-11,14,20H,12H2,1-3H3.
What are the key properties of N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide?
N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide has a molecular weight of 283.37 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxyphenyl)ethyl]-N-methyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 61043693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).