2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide

C19H18N2O2 — CID 110734260

IUPAC2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide
SMILESCc1cccc(OCC(=O)NCc2ccnc3ccccc23)c1
InChIInChI=1S/C19H18N2O2/c1-14-5-4-6-16(11-14)23-13-19(22)21-12-15-9-10-20-18-8-3-2-7-17(15)18/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyYMGXJVHTMWBZIS-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.24
Rot. Bonds5

About 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide

2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide (PubChem CID 110734260) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide
PubChem CID110734260
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC Name2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide
SMILESCc1cccc(OCC(=O)NCc2ccnc3ccccc23)c1
InChIInChI=1S/C19H18N2O2/c1-14-5-4-6-16(11-14)23-13-19(22)21-12-15-9-10-20-18-8-3-2-7-17(15)18/h2-11H,12-13H2,1H3,(H,21,22)
InChIKeyYMGXJVHTMWBZIS-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-4-ylmethyl)acetamide
CID 110734253
2-(3,5-dimethylphenoxy)-N-[(2-methylquinolin-4-yl)methyl]acetamide
CID 4915926
N-[(2-ethoxyphenyl)methyl]-2-(3-methylphenoxy)acetamide
CID 53288654
N'-acridin-9-yl-2-(3-methylphenoxy)acetohydrazide
CID 2962367
N-[[2-(ethoxymethyl)phenyl]methyl]-2-(3-methylphenoxy)acetamide
CID 37398686
diethyl-[[2-[[[2-(3-methylphenoxy)acetyl]amino]methyl]phenyl]methyl]azanium
CID 9073302
2-(3-methylphenoxy)-N-[(1,2,5-trimethylpyrrol-3-yl)methyl]acetamide
CID 110786230
2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979329
2-(3-methylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 4784838
2-(1H-indol-3-yl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 26901683
N-[(1-methyl-2-oxo-3-pyridinyl)methyl]-2-(3-methylphenoxy)acetamide
CID 110730402
N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]-2-(3-methylphenoxy)acetamide
CID 110714847

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide (CID 110734260) is 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide is Cc1cccc(OCC(=O)NCc2ccnc3ccccc23)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The InChIKey is YMGXJVHTMWBZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-14-5-4-6-16(11-14)23-13-19(22)21-12-15-9-10-20-18-8-3-2-7-17(15)18/h2-11H,12-13H2,1H3,(H,21,22).
What are the key properties of 2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide?
2-(3-methylphenoxy)-N-(quinolin-4-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-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide is sourced from PubChem (CID 110734260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).