2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide

C16H18N2O3 — CID 79157217

IUPAC2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2C)c(CO)n1
InChIInChI=1S/C16H18N2O3/c1-11-5-3-4-6-13(11)18-16(20)10-21-15-8-7-12(2)17-14(15)9-19/h3-8,19H,9-10H2,1-2H3,(H,18,20)
InChIKeyLBKIETRNAYLSHE-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.21
Rot. Bonds5

About 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide

2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide (PubChem CID 79157217) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide
PubChem CID79157217
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2C)c(CO)n1
InChIInChI=1S/C16H18N2O3/c1-11-5-3-4-6-13(11)18-16(20)10-21-15-8-7-12(2)17-14(15)9-19/h3-8,19H,9-10H2,1-2H3,(H,18,20)
InChIKeyLBKIETRNAYLSHE-UHFFFAOYSA-N
XLogP2.21
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-methylacetamide
CID 79157830
2-[4-fluoro-2-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)acetamide
CID 107698413
2-(1-formylnaphthalen-2-yl)oxy-N-(2-methylphenyl)acetamide
CID 7763468
2-[4-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)acetamide
CID 28561557
methyl 3-bromo-4-[2-(2-methylanilino)-2-oxoethoxy]benzoate
CID 36531543
2-(2-methoxyphenoxy)-N-(2-methylquinolin-8-yl)acetamide
CID 17012818
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methylphenyl)acetamide
CID 112996058
2-(2-amino-4-fluorophenoxy)-N-(2-methylphenyl)acetamide
CID 62368683
2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929098
N-(2-chlorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929086
2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(2-methylphenyl)acetamide
CID 28857578

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide (CID 79157217) is 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide is Cc1ccc(OCC(=O)Nc2ccccc2C)c(CO)n1.
What is the InChIKey of 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide?
The InChIKey is LBKIETRNAYLSHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-5-3-4-6-13(11)18-16(20)10-21-15-8-7-12(2)17-14(15)9-19/h3-8,19H,9-10H2,1-2H3,(H,18,20).
What are the key properties of 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide?
2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 79157217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).