2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide

C22H24N2O2 — CID 52706430

IUPAC2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide
SMILESCc1ccccc1OCCNC(=O)Cc1c(C)nc2ccccc2c1C
InChIInChI=1S/C22H24N2O2/c1-15-8-4-7-11-21(15)26-13-12-23-22(25)14-19-16(2)18-9-5-6-10-20(18)24-17(19)3/h4-11H,12-14H2,1-3H3,(H,23,25)
InChIKeyOWHIWLRSECJYBG-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.90
Rot. Bonds6

About 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide

2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide (PubChem CID 52706430) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide
PubChem CID52706430
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide
SMILESCc1ccccc1OCCNC(=O)Cc1c(C)nc2ccccc2c1C
InChIInChI=1S/C22H24N2O2/c1-15-8-4-7-11-21(15)26-13-12-23-22(25)14-19-16(2)18-9-5-6-10-20(18)24-17(19)3/h4-11H,12-14H2,1-3H3,(H,23,25)
InChIKeyOWHIWLRSECJYBG-UHFFFAOYSA-N
XLogP3.90
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,4-dimethylquinolin-3-yl)-N-(2-phenoxyethyl)acetamide
CID 17393557
2-(2,4-dimethylquinolin-3-yl)-N-[2-[di(propan-2-yl)amino]ethyl]acetamide
CID 18160718
3-[2-[[2-(2,4-dimethylquinolin-3-yl)acetyl]amino]phenoxy]propanamide
CID 60530589
2-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[3-(2-methylphenoxy)propyl]acetamide
CID 56826665
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 78810073
2-(2,4-dimethylquinolin-3-yl)-N-quinolin-3-ylacetamide
CID 18146501
N-[2-(cyclopropylamino)-2-oxoethyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 18163674
N-[2-(1-benzylimidazol-2-yl)ethyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 134039609
2-amino-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119300070
N-[2-(2-methylphenoxy)ethyl]-3-phenylpropanamide
CID 600522
2-(methylamino)-N-[2-(2-methylphenoxy)ethyl]acetamide;hydrochloride
CID 119742926
2-chloro-N'-[2-(2,4-dimethylquinolin-3-yl)acetyl]benzohydrazide
CID 32925933

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide?
The IUPAC name of 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide (CID 52706430) is 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide?
The canonical SMILES for 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide is Cc1ccccc1OCCNC(=O)Cc1c(C)nc2ccccc2c1C.
What is the InChIKey of 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide?
The InChIKey is OWHIWLRSECJYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-15-8-4-7-11-21(15)26-13-12-23-22(25)14-19-16(2)18-9-5-6-10-20(18)24-17(19)3/h4-11H,12-14H2,1-3H3,(H,23,25).
What are the key properties of 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide?
2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide has a molecular weight of 348.45 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylquinolin-3-yl)-N-[2-(2-methylphenoxy)ethyl]acetamide is sourced from PubChem (CID 52706430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).