3-(quinolin-2-ylamino)piperidin-2-one

C14H15N3O — CID 62091961

IUPAC3-(quinolin-2-ylamino)piperidin-2-one
SMILESO=C1NCCCC1Nc1ccc2ccccc2n1
InChIInChI=1S/C14H15N3O/c18-14-12(6-3-9-15-14)17-13-8-7-10-4-1-2-5-11(10)16-13/h1-2,4-5,7-8,12H,3,6,9H2,(H,15,18)(H,16,17)
InChIKeyXYPKPAWCNMWDAA-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.93
Rot. Bonds2

About 3-(quinolin-2-ylamino)piperidin-2-one

3-(quinolin-2-ylamino)piperidin-2-one (PubChem CID 62091961) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-(quinolin-2-ylamino)piperidin-2-one.

Molecular Properties

Compound Name3-(quinolin-2-ylamino)piperidin-2-one
PubChem CID62091961
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-(quinolin-2-ylamino)piperidin-2-one
SMILESO=C1NCCCC1Nc1ccc2ccccc2n1
InChIInChI=1S/C14H15N3O/c18-14-12(6-3-9-15-14)17-13-8-7-10-4-1-2-5-11(10)16-13/h1-2,4-5,7-8,12H,3,6,9H2,(H,15,18)(H,16,17)
InChIKeyXYPKPAWCNMWDAA-UHFFFAOYSA-N
XLogP1.93
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-2-ylamino)piperidin-2-one?
The IUPAC name of 3-(quinolin-2-ylamino)piperidin-2-one (CID 62091961) is 3-(quinolin-2-ylamino)piperidin-2-one.
What is the SMILES notation for 3-(quinolin-2-ylamino)piperidin-2-one?
The canonical SMILES for 3-(quinolin-2-ylamino)piperidin-2-one is O=C1NCCCC1Nc1ccc2ccccc2n1.
What is the InChIKey of 3-(quinolin-2-ylamino)piperidin-2-one?
The InChIKey is XYPKPAWCNMWDAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c18-14-12(6-3-9-15-14)17-13-8-7-10-4-1-2-5-11(10)16-13/h1-2,4-5,7-8,12H,3,6,9H2,(H,15,18)(H,16,17).
What are the key properties of 3-(quinolin-2-ylamino)piperidin-2-one?
3-(quinolin-2-ylamino)piperidin-2-one has a molecular weight of 241.29 g/mol, XLogP of 1.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-2-ylamino)piperidin-2-one is sourced from PubChem (CID 62091961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).