6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

C13H19N3O — CID 115039715

IUPAC6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCCc2nc(C3CCCN3)cc(=O)n21
InChIInChI=1S/C13H19N3O/c1-9-4-2-6-12-15-11(8-13(17)16(9)12)10-5-3-7-14-10/h8-10,14H,2-7H2,1H3
InChIKeyBRIAXFYHUOGYJK-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.57
Rot. Bonds1

About 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one

6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (PubChem CID 115039715) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
PubChem CID115039715
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
SMILESCC1CCCc2nc(C3CCCN3)cc(=O)n21
InChIInChI=1S/C13H19N3O/c1-9-4-2-6-12-15-11(8-13(17)16(9)12)10-5-3-7-14-10/h8-10,14H,2-7H2,1H3
InChIKeyBRIAXFYHUOGYJK-UHFFFAOYSA-N
XLogP1.57
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one (CID 115039715) is 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is CC1CCCc2nc(C3CCCN3)cc(=O)n21.
What is the InChIKey of 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
The InChIKey is BRIAXFYHUOGYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-4-2-6-12-15-11(8-13(17)16(9)12)10-5-3-7-14-10/h8-10,14H,2-7H2,1H3.
What are the key properties of 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one?
6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one has a molecular weight of 233.31 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-pyrrolidin-2-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 115039715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).