3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one

C19H24N4O3 — CID 70751315

IUPAC3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
SMILESO=C(c1cnc2ccccn2c1=O)N1CCCCC1CN1CCOCC1
InChIInChI=1S/C19H24N4O3/c24-18(16-13-20-17-6-2-4-8-23(17)19(16)25)22-7-3-1-5-15(22)14-21-9-11-26-12-10-21/h2,4,6,8,13,15H,1,3,5,7,9-12,14H2
InChIKeyXTKWHAPOPIPNKT-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.02
Rot. Bonds3

About 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one

3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one (PubChem CID 70751315) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
PubChem CID70751315
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC Name3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one
SMILESO=C(c1cnc2ccccn2c1=O)N1CCCCC1CN1CCOCC1
InChIInChI=1S/C19H24N4O3/c24-18(16-13-20-17-6-2-4-8-23(17)19(16)25)22-7-3-1-5-15(22)14-21-9-11-26-12-10-21/h2,4,6,8,13,15H,1,3,5,7,9-12,14H2
InChIKeyXTKWHAPOPIPNKT-UHFFFAOYSA-N
XLogP1.02
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one (CID 70751315) is 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one is O=C(c1cnc2ccccn2c1=O)N1CCCCC1CN1CCOCC1.
What is the InChIKey of 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is XTKWHAPOPIPNKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c24-18(16-13-20-17-6-2-4-8-23(17)19(16)25)22-7-3-1-5-15(22)14-21-9-11-26-12-10-21/h2,4,6,8,13,15H,1,3,5,7,9-12,14H2.
What are the key properties of 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one?
3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 356.43 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 70751315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).