4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one

C14H15N3O2 — CID 168699530

IUPAC4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
SMILESCOc1ccc(N2CC(N)CC2=O)c2cccnc12
InChIInChI=1S/C14H15N3O2/c1-19-12-5-4-11(10-3-2-6-16-14(10)12)17-8-9(15)7-13(17)18/h2-6,9H,7-8,15H2,1H3
InChIKeyOBGKDBRVUTVPPW-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.31
Rot. Bonds2

About 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one

4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one (PubChem CID 168699530) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
PubChem CID168699530
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
SMILESCOc1ccc(N2CC(N)CC2=O)c2cccnc12
InChIInChI=1S/C14H15N3O2/c1-19-12-5-4-11(10-3-2-6-16-14(10)12)17-8-9(15)7-13(17)18/h2-6,9H,7-8,15H2,1H3
InChIKeyOBGKDBRVUTVPPW-UHFFFAOYSA-N
XLogP1.31
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one
CID 168702268
4-amino-1-(4-methoxy-3-pyridinyl)pyrrolidin-2-one
CID 168699582
4-(aminomethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
CID 168659792
8-methoxy-5-piperidin-1-ylquinoline
CID 86218648
4-amino-1-(2-fluoro-3-methoxyphenyl)pyrrolidin-2-one
CID 83807533
(2R,6S)-4-(8-methoxyquinolin-5-yl)-2,6-dimethylmorpholine
CID 118006697
4-(hydroxymethyl)-1-(8-methylquinolin-5-yl)pyrrolidin-2-one
CID 168662622
[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
4-amino-1-(4-bromonaphthalen-1-yl)pyrrolidin-2-one
CID 113384546
4-amino-1-(5-bromo-3-methoxy-2-pyridinyl)pyrrolidin-2-one
CID 168699602

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one?
The IUPAC name of 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one (CID 168699530) is 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one.
What is the SMILES notation for 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one?
The canonical SMILES for 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one is COc1ccc(N2CC(N)CC2=O)c2cccnc12.
What is the InChIKey of 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one?
The InChIKey is OBGKDBRVUTVPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-19-12-5-4-11(10-3-2-6-16-14(10)12)17-8-9(15)7-13(17)18/h2-6,9H,7-8,15H2,1H3.
What are the key properties of 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one?
4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one has a molecular weight of 257.29 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(8-methoxyquinolin-5-yl)pyrrolidin-2-one is sourced from PubChem (CID 168699530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).