2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide

C19H18N2O2 — CID 110733809

IUPAC2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide
SMILESCc1ccccc1OCC(=O)NCc1cnc2ccccc2c1
InChIInChI=1S/C19H18N2O2/c1-14-6-2-5-9-18(14)23-13-19(22)21-12-15-10-16-7-3-4-8-17(16)20-11-15/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyRXCIZHGPRABWNH-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.24
Rot. Bonds5

About 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide

2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide (PubChem CID 110733809) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide
PubChem CID110733809
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide
SMILESCc1ccccc1OCC(=O)NCc1cnc2ccccc2c1
InChIInChI=1S/C19H18N2O2/c1-14-6-2-5-9-18(14)23-13-19(22)21-12-15-10-16-7-3-4-8-17(16)20-11-15/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyRXCIZHGPRABWNH-UHFFFAOYSA-N
XLogP3.24
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylphenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733803
3-(4-fluorophenyl)-N-(quinolin-3-ylmethyl)propanamide
CID 110733799
2-methyl-N-(quinolin-3-ylmethyl)propanamide
CID 110733747
2-(2-methylphenoxy)-N-[(5-thiophen-2-yl-3-pyridinyl)methyl]acetamide
CID 91630595
2-(2-fluorophenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733805
N-[(3-acetamidophenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 39575947
2-ethyl-N-(quinolin-3-ylmethyl)butanamide
CID 110733756
2-(2-methylphenoxy)-N-[(1-propan-2-ylbenzimidazol-5-yl)methyl]acetamide
CID 110785922
N-benzyl-2-(5-fluoro-2-methylphenoxy)acetamide
CID 102975403
N-[(1-methylindol-3-yl)methyl]-2-(2-methylphenoxy)acetamide
CID 110782279
2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-(quinolin-3-ylmethyl)acetamide
CID 166193747
N-[(2-ethoxyphenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 46778184

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide?
The IUPAC name of 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide (CID 110733809) is 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide is Cc1ccccc1OCC(=O)NCc1cnc2ccccc2c1.
What is the InChIKey of 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide?
The InChIKey is RXCIZHGPRABWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-14-6-2-5-9-18(14)23-13-19(22)21-12-15-10-16-7-3-4-8-17(16)20-11-15/h2-11H,12-13H2,1H3,(H,21,22).
What are the key properties of 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide?
2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide has a molecular weight of 306.37 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)-N-(quinolin-3-ylmethyl)acetamide is sourced from PubChem (CID 110733809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).