9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

C21H24N4O2 — CID 122179708

IUPAC9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCC1=C(C(=CC=C1)C)NC2=CC(=CN3C2=NC(=CC3=O)N4CCOCC4)C
InChIInChI=1S/C21H24N4O2/c1-14-11-17(22-20-15(2)5-4-6-16(20)3)21-23-18(12-19(26)25(21)13-14)24-7-9-27-10-8-24/h4-6,11-13,22H,7-10H2,1-3H3
InChIKeyCFIHAKPMLHAESV-UHFFFAOYSA-N
MW364.40 g/mol
LogP2.50
Rot. Bonds3

About 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 122179708) has the molecular formula C21H24N4O2 and a molecular weight of 364.40 g/mol. Its IUPAC name is 9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID122179708
Molecular FormulaC21H24N4O2
Molecular Weight364.40 g/mol
Exact Mass364.19
IUPAC Name9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESCC1=C(C(=CC=C1)C)NC2=CC(=CN3C2=NC(=CC3=O)N4CCOCC4)C
InChIInChI=1S/C21H24N4O2/c1-14-11-17(22-20-15(2)5-4-6-16(20)3)21-23-18(12-19(26)25(21)13-14)24-7-9-27-10-8-24/h4-6,11-13,22H,7-10H2,1-3H3
InChIKeyCFIHAKPMLHAESV-UHFFFAOYSA-N
XLogP2.50
TPSA57.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity720

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one with MolForge

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Related Compounds

Tgx-221
CID 9907093
(5R)-9-[(1R)-1-anilinoethyl]-7-methyl-2-(morpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 51601993
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-9-(2-methylanilino)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 57798309
7-methyl-2-morpholin-4-yl-9-[[(1S)-1-phenylethyl]amino]pyrido[1,2-a]pyrimidin-4-one
CID 59753763
9-[1-(4-Fluoroanilino)ethyl]-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839794
7-Methyl-9-[1-(3-methylanilino)ethyl]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839834
7-Methyl-9-[(3-methylphenyl)methylamino]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 68547896
N-(3-methylphenyl)-2-[4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetamide
CID 136041737
N-(2-methylphenyl)-2-[4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetamide
CID 136230227

Frequently Asked Questions

What is the IUPAC name of 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 122179708) is 9-(2,6-dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is CC1=C(C(=CC=C1)C)NC2=CC(=CN3C2=NC(=CC3=O)N4CCOCC4)C.
What is the InChIKey of 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is CFIHAKPMLHAESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-14-11-17(22-20-15(2)5-4-6-16(20)3)21-23-18(12-19(26)25(21)13-14)24-7-9-27-10-8-24/h4-6,11-13,22H,7-10H2,1-3H3.
What are the key properties of 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 364.40 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,6-Dimethylanilino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 122179708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).