2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone

C19H17NO3 — CID 162664426

IUPAC2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone
SMILESCOc1ccc2nc(C)cc(OCC(=O)c3ccccc3)c2c1
InChIInChI=1S/C19H17NO3/c1-13-10-19(16-11-15(22-2)8-9-17(16)20-13)23-12-18(21)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyQLPTZHWTTMDWGX-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.81
Rot. Bonds5

About 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone

2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone (PubChem CID 162664426) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone.

Molecular Properties

Compound Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone
PubChem CID162664426
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone
SMILESCOc1ccc2nc(C)cc(OCC(=O)c3ccccc3)c2c1
InChIInChI=1S/C19H17NO3/c1-13-10-19(16-11-15(22-2)8-9-17(16)20-13)23-12-18(21)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKeyQLPTZHWTTMDWGX-UHFFFAOYSA-N
XLogP3.81
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(4-methylphenyl)ethanone
CID 162667689
1-(3-chlorophenyl)-2-(6-methoxy-2-methylquinolin-4-yl)oxyethanone
CID 162672729
2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-(2-methoxyphenyl)ethanone
CID 162677128
N,N-diethyl-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 112787506
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-[(4-methoxyphenyl)methyl]acetamide
CID 112787491
2-(6-methoxy-2-methylquinolin-4-yl)oxy-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 112787517
N-[(2S)-butan-2-yl]-2-(6-methoxy-2-methylquinolin-4-yl)oxyacetamide
CID 40711295
2-(2-methylquinolin-4-yl)oxyacetic acid
CID 658584
N-(3-methoxyphenyl)-2-(2-methylquinolin-4-yl)oxyacetamide
CID 99835658
1-(4-methoxyphenyl)-2-naphthalen-1-yloxyethanone
CID 896643
8-methoxy-4-methyl-3-phenacyloxybenzo[c]chromen-6-one
CID 2185542
methyl 2-(6-methoxy-2-methylquinolin-4-yl)oxypropanoate
CID 53269444

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone?
The IUPAC name of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone (CID 162664426) is 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone.
What is the SMILES notation for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone?
The canonical SMILES for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone is COc1ccc2nc(C)cc(OCC(=O)c3ccccc3)c2c1.
What is the InChIKey of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone?
The InChIKey is QLPTZHWTTMDWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-13-10-19(16-11-15(22-2)8-9-17(16)20-13)23-12-18(21)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3.
What are the key properties of 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone?
2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone has a molecular weight of 307.35 g/mol, XLogP of 3.81, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-2-methylquinolin-4-yl)oxy-1-phenylethanone is sourced from PubChem (CID 162664426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).