4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one

C14H14N2O2 — CID 168703096

IUPAC4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one
SMILESO=C1CC(O)CN1Cc1ccnc2ccccc12
InChIInChI=1S/C14H14N2O2/c17-11-7-14(18)16(9-11)8-10-5-6-15-13-4-2-1-3-12(10)13/h1-6,11,17H,7-9H2
InChIKeyYSFIHUCPTRXIBU-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.33
Rot. Bonds2

About 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one

4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one (PubChem CID 168703096) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one
PubChem CID168703096
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one
SMILESO=C1CC(O)CN1Cc1ccnc2ccccc12
InChIInChI=1S/C14H14N2O2/c17-11-7-14(18)16(9-11)8-10-5-6-15-13-4-2-1-3-12(10)13/h1-6,11,17H,7-9H2
InChIKeyYSFIHUCPTRXIBU-UHFFFAOYSA-N
XLogP1.33
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-oxo-1-(quinolin-4-ylmethyl)pyrrolidine-3-sulfonyl chloride
CID 168712231
1-(quinolin-4-ylmethyl)-1,4-diazepane-2,5-dione
CID 79240641
1-amino-3-(quinolin-4-ylmethyl)-1,3-diazinan-2-one
CID 104601300
1-(quinolin-4-ylmethyl)piperidin-4-one
CID 79235169
(3R,4R)-4-(4-hydroxypiperidin-1-yl)-1-(quinolin-4-ylmethyl)piperidin-3-ol
CID 28768711
6-oxo-1-(quinolin-4-ylmethyl)-4,5-dihydropyridazine-3-carboxylic acid
CID 79231197
4-(pyrrol-1-ylmethyl)quinoline
CID 79240222
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(quinolin-4-ylmethyl)acetamide
CID 125175300
4-hydroxy-1-(2-quinolin-6-ylethyl)pyrrolidin-2-one
CID 168702962
1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-quinolin-4-ylethanone
CID 79960182
1-(2-methylpropyl)-6-(pyridin-4-ylmethoxy)-4-(quinolin-4-ylmethyl)-1,4-diazepan-2-one
CID 45163509
4-[(3-chloropiperidin-1-yl)methyl]quinoline
CID 79240792

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one?
The IUPAC name of 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one (CID 168703096) is 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one.
What is the SMILES notation for 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one?
The canonical SMILES for 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one is O=C1CC(O)CN1Cc1ccnc2ccccc12.
What is the InChIKey of 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one?
The InChIKey is YSFIHUCPTRXIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c17-11-7-14(18)16(9-11)8-10-5-6-15-13-4-2-1-3-12(10)13/h1-6,11,17H,7-9H2.
What are the key properties of 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one?
4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one has a molecular weight of 242.28 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(quinolin-4-ylmethyl)pyrrolidin-2-one is sourced from PubChem (CID 168703096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).