N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide

C19H18N4O3 — CID 122179718

IUPACN-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
SMILESO=C(Nc1cccn2c(=O)cc(N3CCOCC3)nc12)c1ccccc1
InChIInChI=1S/C19H18N4O3/c24-17-13-16(22-9-11-26-12-10-22)21-18-15(7-4-8-23(17)18)20-19(25)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25)
InChIKeyLHVSIQFUEHPCOJ-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.78
Rot. Bonds3

About N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide

N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide (PubChem CID 122179718) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
PubChem CID122179718
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
SMILESO=C(Nc1cccn2c(=O)cc(N3CCOCC3)nc12)c1ccccc1
InChIInChI=1S/C19H18N4O3/c24-17-13-16(22-9-11-26-12-10-22)21-18-15(7-4-8-23(17)18)20-19(25)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25)
InChIKeyLHVSIQFUEHPCOJ-UHFFFAOYSA-N
XLogP1.78
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The IUPAC name of N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide (CID 122179718) is N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide.
What is the SMILES notation for N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The canonical SMILES for N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide is O=C(Nc1cccn2c(=O)cc(N3CCOCC3)nc12)c1ccccc1.
What is the InChIKey of N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The InChIKey is LHVSIQFUEHPCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c24-17-13-16(22-9-11-26-12-10-22)21-18-15(7-4-8-23(17)18)20-19(25)14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25).
What are the key properties of N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide has a molecular weight of 350.38 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide is sourced from PubChem (CID 122179718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).