1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one

C23H20N2O3 — CID 69080163

IUPAC1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc2nc(CCO)ccc2c1
InChIInChI=1S/C23H20N2O3/c26-13-11-19-7-6-18-14-20(8-9-22(18)24-19)25-12-10-21(15-23(25)27)28-16-17-4-2-1-3-5-17/h1-10,12,14-15,26H,11,13,16H2
InChIKeyQYNICHQLLAALPP-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.50
Rot. Bonds6

About 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one

1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one (PubChem CID 69080163) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one.

Molecular Properties

Compound Name1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one
PubChem CID69080163
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc2nc(CCO)ccc2c1
InChIInChI=1S/C23H20N2O3/c26-13-11-19-7-6-18-14-20(8-9-22(18)24-19)25-12-10-21(15-23(25)27)28-16-17-4-2-1-3-5-17/h1-10,12,14-15,26H,11,13,16H2
InChIKeyQYNICHQLLAALPP-UHFFFAOYSA-N
XLogP3.50
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(2-aminoethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one
CID 71080950
1-[2-[2-[amino(propyl)amino]ethyl]quinolin-6-yl]-4-phenylmethoxypyridin-2-one
CID 143424274
4-[(4-fluorophenyl)methoxy]-1-[2-(hydroxymethyl)quinolin-6-yl]pyridin-2-one
CID 69082097
1-(1-methylindazol-5-yl)-4-phenylmethoxypyridin-2-one
CID 143723289
1-(4-bromophenyl)-4-phenylmethoxypyridin-2-one
CID 59187025
1-(4-iodo-3-methylphenyl)-4-phenylmethoxypyridin-2-one
CID 143591111
1-[4-[2-(diethylamino)ethyl-methylamino]phenyl]-4-phenylmethoxypyridin-2-one
CID 53318595
1-[1-(2-methoxypropyl)indazol-5-yl]-4-phenylmethoxypyridin-2-one
CID 143723312
1-(2-acetyl-3H-benzimidazol-5-yl)-4-[(4-fluorophenyl)methoxy]pyridin-2-one
CID 123190083
4-phenylmethoxy-1-[4-(propylamino)phenyl]pyridin-2-one
CID 24780169
1-[4-[2-(dimethylamino)ethylamino]phenyl]-4-phenylmethoxypyridin-2-one
CID 24780171
[2-methoxy-4-(2-oxo-4-phenylmethoxy-1-pyridinyl)phenyl] trifluoromethanesulfonate
CID 59187052

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one?
The IUPAC name of 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one (CID 69080163) is 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one.
What is the SMILES notation for 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one?
The canonical SMILES for 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one is O=c1cc(OCc2ccccc2)ccn1-c1ccc2nc(CCO)ccc2c1.
What is the InChIKey of 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one?
The InChIKey is QYNICHQLLAALPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c26-13-11-19-7-6-18-14-20(8-9-22(18)24-19)25-12-10-21(15-23(25)27)28-16-17-4-2-1-3-5-17/h1-10,12,14-15,26H,11,13,16H2.
What are the key properties of 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one?
1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one has a molecular weight of 372.42 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxyethyl)quinolin-6-yl]-4-phenylmethoxypyridin-2-one is sourced from PubChem (CID 69080163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).