4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one

C15H16N2O2 — CID 168662622

IUPAC4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
SMILESCc1ccc(N2CC(CO)CC2=O)c2cccnc12
InChIInChI=1S/C15H16N2O2/c1-10-4-5-13(12-3-2-6-16-15(10)12)17-8-11(9-18)7-14(17)19/h2-6,11,18H,7-9H2,1H3
InChIKeyALTXAJFWQOUDSL-UHFFFAOYSA-N
MW256.30 g/mol
LogP1.89
Rot. Bonds2

About 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one

4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one (PubChem CID 168662622) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
PubChem CID168662622
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
SMILESCc1ccc(N2CC(CO)CC2=O)c2cccnc12
InChIInChI=1S/C15H16N2O2/c1-10-4-5-13(12-3-2-6-16-15(10)12)17-8-11(9-18)7-14(17)19/h2-6,11,18H,7-9H2,1H3
InChIKeyALTXAJFWQOUDSL-UHFFFAOYSA-N
XLogP1.89
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
CID 168659792
[1-(8-methylquinolin-5-yl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681419
4-ethynyl-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
CID 168501102
4-(aminomethyl)-1-(1,10-phenanthrolin-5-yl)pyrrolidin-2-one
CID 168661050
1-(3-bromo-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663841
4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168699530
4-hydroxy-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168702268
1-(5-bromonaphthalen-1-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168663904
4-(azidomethyl)-1-(1,10-phenanthrolin-5-yl)pyrrolidin-2-one
CID 168658182
1-(3,5-dimethyl-2-pyridinyl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168662656
1-(2-chloroquinolin-4-yl)-4-(hydroxymethyl)pyrrolidin-2-one
CID 168664003
4-(hydroxymethyl)-1-(2-methylsulfonylphenyl)pyrrolidin-2-one
CID 168662518

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one?
The IUPAC name of 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one (CID 168662622) is 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one.
What is the SMILES notation for 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one?
The canonical SMILES for 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one is Cc1ccc(N2CC(CO)CC2=O)c2cccnc12.
What is the InChIKey of 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one?
The InChIKey is ALTXAJFWQOUDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-4-5-13(12-3-2-6-16-15(10)12)17-8-11(9-18)7-14(17)19/h2-6,11,18H,7-9H2,1H3.
What are the key properties of 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one?
4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one has a molecular weight of 256.30 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one is sourced from PubChem (CID 168662622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).