3-(quinolin-8-ylmethylamino)piperidin-2-one

C15H17N3O — CID 55033199

IUPAC3-(quinolin-8-ylmethylamino)piperidin-2-one
SMILESO=C1NCCCC1NCc1cccc2cccnc12
InChIInChI=1S/C15H17N3O/c19-15-13(7-3-9-17-15)18-10-12-5-1-4-11-6-2-8-16-14(11)12/h1-2,4-6,8,13,18H,3,7,9-10H2,(H,17,19)
InChIKeyLDYZZNWGJKVJLX-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.60
Rot. Bonds3

About 3-(quinolin-8-ylmethylamino)piperidin-2-one

3-(quinolin-8-ylmethylamino)piperidin-2-one (PubChem CID 55033199) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-(quinolin-8-ylmethylamino)piperidin-2-one.

Molecular Properties

Compound Name3-(quinolin-8-ylmethylamino)piperidin-2-one
PubChem CID55033199
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name3-(quinolin-8-ylmethylamino)piperidin-2-one
SMILESO=C1NCCCC1NCc1cccc2cccnc12
InChIInChI=1S/C15H17N3O/c19-15-13(7-3-9-17-15)18-10-12-5-1-4-11-6-2-8-16-14(11)12/h1-2,4-6,8,13,18H,3,7,9-10H2,(H,17,19)
InChIKeyLDYZZNWGJKVJLX-UHFFFAOYSA-N
XLogP1.60
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(quinolin-8-ylmethylamino)pyrrolidine-2,5-dione
CID 81426474
3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethylamino)piperidin-2-one
CID 66415273
3-[(2,3-dichlorophenyl)methylamino]piperidin-2-one
CID 62094465
3-[(2-ethylphenyl)methylamino]piperidin-2-one
CID 62392646
3-[(2-aminophenyl)methylamino]piperidin-2-one
CID 66417485
3-(pyridin-2-ylmethylamino)piperidin-2-one
CID 62092104
3-[(3-methyl-2-pyridinyl)methylamino]piperidin-2-one
CID 112699998
3-(pyridin-2-ylmethylamino)azepan-2-one
CID 43199271
(2S,3S)-2-phenyl-N-(quinolin-8-ylmethyl)piperidin-3-amine;hydrochloride
CID 67619110
3-[(2-fluoro-3-methoxyphenyl)methylamino]piperidin-2-one
CID 104791742
(3S)-3-(benzylamino)azepan-2-one
CID 40582762
3-(pyrimidin-4-ylmethylamino)piperidin-2-one
CID 62748926

Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-8-ylmethylamino)piperidin-2-one?
The IUPAC name of 3-(quinolin-8-ylmethylamino)piperidin-2-one (CID 55033199) is 3-(quinolin-8-ylmethylamino)piperidin-2-one.
What is the SMILES notation for 3-(quinolin-8-ylmethylamino)piperidin-2-one?
The canonical SMILES for 3-(quinolin-8-ylmethylamino)piperidin-2-one is O=C1NCCCC1NCc1cccc2cccnc12.
What is the InChIKey of 3-(quinolin-8-ylmethylamino)piperidin-2-one?
The InChIKey is LDYZZNWGJKVJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c19-15-13(7-3-9-17-15)18-10-12-5-1-4-11-6-2-8-16-14(11)12/h1-2,4-6,8,13,18H,3,7,9-10H2,(H,17,19).
What are the key properties of 3-(quinolin-8-ylmethylamino)piperidin-2-one?
3-(quinolin-8-ylmethylamino)piperidin-2-one has a molecular weight of 255.32 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-8-ylmethylamino)piperidin-2-one is sourced from PubChem (CID 55033199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).