2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide

C19H18N4O3 — CID 122179711

IUPAC2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide
SMILESO=C(Nc1ccccc1)c1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C19H18N4O3/c24-17-13-16(22-9-11-26-12-10-22)21-18-15(7-4-8-23(17)18)19(25)20-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25)
InChIKeyUOHYRBALHABNDV-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.78
Rot. Bonds3

About 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide

2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide (PubChem CID 122179711) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide.

Molecular Properties

Compound Name2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide
PubChem CID122179711
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide
SMILESO=C(Nc1ccccc1)c1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C19H18N4O3/c24-17-13-16(22-9-11-26-12-10-22)21-18-15(7-4-8-23(17)18)19(25)20-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25)
InChIKeyUOHYRBALHABNDV-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 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide?
The IUPAC name of 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide (CID 122179711) is 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide.
What is the SMILES notation for 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide?
The canonical SMILES for 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide is O=C(Nc1ccccc1)c1cccn2c(=O)cc(N3CCOCC3)nc12.
What is the InChIKey of 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide?
The InChIKey is UOHYRBALHABNDV-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)19(25)20-14-5-2-1-3-6-14/h1-8,13H,9-12H2,(H,20,25).
What are the key properties of 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide?
2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide 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 2-morpholin-4-yl-4-oxo-N-phenylpyrido[1,2-a]pyrimidine-9-carboxamide is sourced from PubChem (CID 122179711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).