2-(2-methylphenoxy)-N-quinolin-6-ylacetamide

C18H16N2O2 — CID 155566022

IUPAC2-(2-methylphenoxy)-N-quinolin-6-ylacetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2ncccc2c1
InChIInChI=1S/C18H16N2O2/c1-13-5-2-3-7-17(13)22-12-18(21)20-15-8-9-16-14(11-15)6-4-10-19-16/h2-11H,12H2,1H3,(H,20,21)
InChIKeyBTCCDMDUPCKKSZ-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.56
Rot. Bonds4

About 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide

2-(2-methylphenoxy)-N-quinolin-6-ylacetamide (PubChem CID 155566022) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)-N-quinolin-6-ylacetamide
PubChem CID155566022
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2-(2-methylphenoxy)-N-quinolin-6-ylacetamide
SMILESCc1ccccc1OCC(=O)Nc1ccc2ncccc2c1
InChIInChI=1S/C18H16N2O2/c1-13-5-2-3-7-17(13)22-12-18(21)20-15-8-9-16-14(11-15)6-4-10-19-16/h2-11H,12H2,1H3,(H,20,21)
InChIKeyBTCCDMDUPCKKSZ-UHFFFAOYSA-N
XLogP3.56
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

SB-649,915
CID 10296414
2-[(6-methoxy-2-methyl-4-quinolyl)oxy]-N-(2-methoxyphenyl)acetamide
CID 70685044
8-Quinolyl N-(2-methoxyphenyl)carbamate
CID 3329723
(R)-N-(3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-hydroxypropyl)-2-(quinolin-8-yloxy)acetamide
CID 90241758
N-[3-[[1-[2-(2-methylquinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]phenyl]acetamide
CID 10173263
N-[3-[[1-[2-(2-methylquinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]phenyl]propanamide
CID 10194809
N-(3-{4-[2-(2-Methylquinolin-5-yloxy)ethyl]piperazin-1-ylmethyl}phenyl)-acetamide
CID 10237964
8-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one
CID 44138098
US10155760, Example 74
CID 91938067
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(4-pentylphenyl)acetamide
CID 137653074
N-[(2-methylquinolin-4-yl)methyl]-2-(4-nitrophenoxy)acetamide
CID 1503106
N-benzyl-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 70682976

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide?
The IUPAC name of 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide (CID 155566022) is 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide.
What is the SMILES notation for 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide?
The canonical SMILES for 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide is Cc1ccccc1OCC(=O)Nc1ccc2ncccc2c1.
What is the InChIKey of 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide?
The InChIKey is BTCCDMDUPCKKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-13-5-2-3-7-17(13)22-12-18(21)20-15-8-9-16-14(11-15)6-4-10-19-16/h2-11H,12H2,1H3,(H,20,21).
What are the key properties of 2-(2-methylphenoxy)-N-quinolin-6-ylacetamide?
2-(2-methylphenoxy)-N-quinolin-6-ylacetamide has a molecular weight of 292.34 g/mol, XLogP of 3.56, 4 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-6-ylacetamide is sourced from PubChem (CID 155566022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).