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

C20H20N4O3 — CID 122179719

IUPAC2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C20H20N4O3/c1-14-5-2-3-6-15(14)20(26)21-16-7-4-8-24-18(25)13-17(22-19(16)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26)
InChIKeyLXOSWIBILOAULT-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.09
Rot. Bonds3

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

2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide (PubChem CID 122179719) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
PubChem CID122179719
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC Name2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C20H20N4O3/c1-14-5-2-3-6-15(14)20(26)21-16-7-4-8-24-18(25)13-17(22-19(16)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26)
InChIKeyLXOSWIBILOAULT-UHFFFAOYSA-N
XLogP2.09
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[4-fluoro-2-(methylcarbamoyl)phenyl]methyl]-3-hydroxy-9,9-dimethyl-4-oxo-6,7-dihydropyrimido[2,1-c][1,4]oxazine-2-carboxamide
CID 54679995
2-morpholinobenzo[h]quinolin-4(1H)-one
CID 25817490
7-methyl-2-morpholin-4-yl-9-[[(1R)-1-phenylethyl]amino]pyrido[1,2-a]pyrimidin-4-one
CID 10021687
9-(Benzylamino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 10269329
7-Methyl-9-[(2-methylphenyl)methylamino]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 11428504
7-methyl-2-morpholin-4-yl-9-[[(1S)-1-phenylethyl]amino]pyrido[1,2-a]pyrimidin-4-one
CID 59753763
7-Methyl-9-[(3-methylphenyl)methylamino]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 68547896
6-imino-11-methyl-N-[(4-methylphenyl)methyl]-7-(2-morpholin-4-ylethyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
CID 3890507
2-imino-10-methyl-1-(2-morpholinoethyl)-5-oxo-N-(1-phenylethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
CID 4996589
7-Methyl-9-[(4-methylphenyl)methylamino]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 122179709
N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
CID 122179718
3-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide
CID 122179720

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The IUPAC name of 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide (CID 122179719) is 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide is Cc1ccccc1C(=O)Nc1cccn2c(=O)cc(N3CCOCC3)nc12.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
The InChIKey is LXOSWIBILOAULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-14-5-2-3-6-15(14)20(26)21-16-7-4-8-24-18(25)13-17(22-19(16)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26).
What are the key properties of 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide?
2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide has a molecular weight of 364.41 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidin-9-yl)benzamide is sourced from PubChem (CID 122179719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).