9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

C19H20N4O2 — CID 122179690

IUPAC9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(N2CCOCC2)nc2c(CNc3ccccc3)cccn12
InChIInChI=1S/C19H20N4O2/c24-18-13-17(22-9-11-25-12-10-22)21-19-15(5-4-8-23(18)19)14-20-16-6-2-1-3-7-16/h1-8,13,20H,9-12,14H2
InChIKeyZYDMPRZESNHZRP-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.14
Rot. Bonds4

About 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one

9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 122179690) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
PubChem CID122179690
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(N2CCOCC2)nc2c(CNc3ccccc3)cccn12
InChIInChI=1S/C19H20N4O2/c24-18-13-17(22-9-11-25-12-10-22)21-19-15(5-4-8-23(18)19)14-20-16-6-2-1-3-7-16/h1-8,13,20H,9-12,14H2
InChIKeyZYDMPRZESNHZRP-UHFFFAOYSA-N
XLogP2.14
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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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
2-[4-(Morpholin-4-Yl)-6-Oxo-1,6-Dihydropyrimidin-2-Yl]-N-Phenylacetamide
CID 135566741
5-Acetyl-6-methyl-4-morpholin-4-yl-1-phenylpyrimidin-2-one
CID 839888
9-(Benzylamino)-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 10269329
N-(3,4-difluorophenyl)-2-[1-methyl-4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetamide
CID 49854022
2-[1-methyl-4-(morpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]-N-phenylacetamide
CID 49854121
7-Methyl-9-(2-methylanilino)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 57798309
9-[1-(3,5-Difluoroanilino)ethyl]-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839776
9-[1-(4-Fluoroanilino)ethyl]-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839794
9-[1-(3-Chloroanilino)ethyl]-7-methyl-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839801
7-Methyl-9-[1-(3-methylanilino)ethyl]-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one
CID 66839834

Frequently Asked Questions

What is the IUPAC name of 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one (CID 122179690) is 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is O=c1cc(N2CCOCC2)nc2c(CNc3ccccc3)cccn12.
What is the InChIKey of 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is ZYDMPRZESNHZRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-18-13-17(22-9-11-25-12-10-22)21-19-15(5-4-8-23(18)19)14-20-16-6-2-1-3-7-16/h1-8,13,20H,9-12,14H2.
What are the key properties of 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one?
9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 336.40 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(anilinomethyl)-2-morpholin-4-ylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 122179690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).