5-methyl-3-piperidin-4-yl-1H-pyridin-2-one

C11H16N2O — CID 135145002

IUPAC5-methyl-3-piperidin-4-yl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)c(C2CCNCC2)c1
InChIInChI=1S/C11H16N2O/c1-8-6-10(11(14)13-7-8)9-2-4-12-5-3-9/h6-7,9,12H,2-5H2,1H3,(H,13,14)
InChIKeyZRQPVUDSYHSNOB-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.15
Rot. Bonds1

About 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one

5-methyl-3-piperidin-4-yl-1H-pyridin-2-one (PubChem CID 135145002) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-methyl-3-piperidin-4-yl-1H-pyridin-2-one
PubChem CID135145002
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name5-methyl-3-piperidin-4-yl-1H-pyridin-2-one
SMILESCc1c[nH]c(=O)c(C2CCNCC2)c1
InChIInChI=1S/C11H16N2O/c1-8-6-10(11(14)13-7-8)9-2-4-12-5-3-9/h6-7,9,12H,2-5H2,1H3,(H,13,14)
InChIKeyZRQPVUDSYHSNOB-UHFFFAOYSA-N
XLogP1.15
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one?
The IUPAC name of 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one (CID 135145002) is 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one is Cc1c[nH]c(=O)c(C2CCNCC2)c1.
What is the InChIKey of 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one?
The InChIKey is ZRQPVUDSYHSNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-6-10(11(14)13-7-8)9-2-4-12-5-3-9/h6-7,9,12H,2-5H2,1H3,(H,13,14).
What are the key properties of 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one?
5-methyl-3-piperidin-4-yl-1H-pyridin-2-one has a molecular weight of 192.26 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-piperidin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 135145002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).