2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one

C15H19N3O — CID 18087389

IUPAC2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCCCN1Cc1cc(=O)n2ccccc2n1
InChIInChI=1S/C15H19N3O/c1-12-6-2-4-8-17(12)11-13-10-15(19)18-9-5-3-7-14(18)16-13/h3,5,7,9-10,12H,2,4,6,8,11H2,1H3
InChIKeyRXYUDDYOFWZAPU-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.07
Rot. Bonds2

About 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one

2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one (PubChem CID 18087389) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one
PubChem CID18087389
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCCCN1Cc1cc(=O)n2ccccc2n1
InChIInChI=1S/C15H19N3O/c1-12-6-2-4-8-17(12)11-13-10-15(19)18-9-5-3-7-14(18)16-13/h3,5,7,9-10,12H,2,4,6,8,11H2,1H3
InChIKeyRXYUDDYOFWZAPU-UHFFFAOYSA-N
XLogP2.07
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one (CID 18087389) is 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one is CC1CCCCN1Cc1cc(=O)n2ccccc2n1.
What is the InChIKey of 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is RXYUDDYOFWZAPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-12-6-2-4-8-17(12)11-13-10-15(19)18-9-5-3-7-14(18)16-13/h3,5,7,9-10,12H,2,4,6,8,11H2,1H3.
What are the key properties of 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one?
2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 257.34 g/mol, XLogP of 2.07, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpiperidin-1-yl)methyl]pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 18087389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).