4-(piperidin-1-ylmethyl)-1H-pyridin-2-one

C11H16N2O — CID 70413111

IUPAC4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
SMILESO=c1cc(CN2CCCCC2)cc[nH]1
InChIInChI=1S/C11H16N2O/c14-11-8-10(4-5-12-11)9-13-6-2-1-3-7-13/h4-5,8H,1-3,6-7,9H2,(H,12,14)
InChIKeyNXSNVGGMSONVJL-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.36
Rot. Bonds2

About 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one

4-(piperidin-1-ylmethyl)-1H-pyridin-2-one (PubChem CID 70413111) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
PubChem CID70413111
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name4-(piperidin-1-ylmethyl)-1H-pyridin-2-one
SMILESO=c1cc(CN2CCCCC2)cc[nH]1
InChIInChI=1S/C11H16N2O/c14-11-8-10(4-5-12-11)9-13-6-2-1-3-7-13/h4-5,8H,1-3,6-7,9H2,(H,12,14)
InChIKeyNXSNVGGMSONVJL-UHFFFAOYSA-N
XLogP1.36
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The IUPAC name of 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one (CID 70413111) is 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The canonical SMILES for 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one is O=c1cc(CN2CCCCC2)cc[nH]1.
What is the InChIKey of 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
The InChIKey is NXSNVGGMSONVJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c14-11-8-10(4-5-12-11)9-13-6-2-1-3-7-13/h4-5,8H,1-3,6-7,9H2,(H,12,14).
What are the key properties of 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one?
4-(piperidin-1-ylmethyl)-1H-pyridin-2-one has a molecular weight of 192.26 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-1-ylmethyl)-1H-pyridin-2-one is sourced from PubChem (CID 70413111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).