N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide

C20H20N4O3 — CID 122179712

IUPACN-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
SMILESCc1ccccc1NC(=O)c1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C20H20N4O3/c1-14-5-2-3-7-16(14)21-20(26)15-6-4-8-24-18(25)13-17(22-19(15)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26)
InChIKeyQSHSDGGNXASYGM-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.09
Rot. Bonds3

About N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide

N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide (PubChem CID 122179712) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
PubChem CID122179712
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
SMILESCc1ccccc1NC(=O)c1cccn2c(=O)cc(N3CCOCC3)nc12
InChIInChI=1S/C20H20N4O3/c1-14-5-2-3-7-16(14)21-20(26)15-6-4-8-24-18(25)13-17(22-19(15)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26)
InChIKeyQSHSDGGNXASYGM-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

Sar-260301
CID 135565159
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
4H-Pyrido(1,2-a)pyrimidine-3-carboxamide, N-(2-methylphenyl)-4-oxo-
CID 3075179
N-Benzyl-2-imino-1-(3-(4-morpholinyl)propyl)-5-oxo-1,5-dihydro-2H-dipyrido(1,2-A:2,3-D)pyrimidine-3-carboxamide
CID 652204
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-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3-methyl-6-(morpholin-4-yl)pyrimidin-4(3H)-one
CID 49854023
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

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide?
The IUPAC name of N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide (CID 122179712) is N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide is Cc1ccccc1NC(=O)c1cccn2c(=O)cc(N3CCOCC3)nc12.
What is the InChIKey of N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide?
The InChIKey is QSHSDGGNXASYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-14-5-2-3-7-16(14)21-20(26)15-6-4-8-24-18(25)13-17(22-19(15)24)23-9-11-27-12-10-23/h2-8,13H,9-12H2,1H3,(H,21,26).
What are the key properties of N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide?
N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide 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 N-(2-methylphenyl)-2-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide is sourced from PubChem (CID 122179712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).