9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid

C15H18N4O5 — CID 91509902

IUPAC9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
SMILESCN(C)c1cc(N2CCOCC2)cn2c(=O)c(O)c(C(=O)O)nc12
InChIInChI=1S/C15H18N4O5/c1-17(2)10-7-9(18-3-5-24-6-4-18)8-19-13(10)16-11(15(22)23)12(20)14(19)21/h7-8,20H,3-6H2,1-2H3,(H,22,23)
InChIKeyWEUANZHRYSSMRL-UHFFFAOYSA-N
MW334.33 g/mol
LogP0.00
Rot. Bonds3

About 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid

9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid (PubChem CID 91509902) has the molecular formula C15H18N4O5 and a molecular weight of 334.33 g/mol. Its IUPAC name is 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
PubChem CID91509902
Molecular FormulaC15H18N4O5
Molecular Weight334.33 g/mol
Exact Mass334.13
IUPAC Name9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
SMILESCN(C)c1cc(N2CCOCC2)cn2c(=O)c(O)c(C(=O)O)nc12
InChIInChI=1S/C15H18N4O5/c1-17(2)10-7-9(18-3-5-24-6-4-18)8-19-13(10)16-11(15(22)23)12(20)14(19)21/h7-8,20H,3-6H2,1-2H3,(H,22,23)
InChIKeyWEUANZHRYSSMRL-UHFFFAOYSA-N
XLogP0.00
TPSA107.61 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.33
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

Methyl 3-hydroxy-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)pyrido[1,2-a]pyrimidine-2-carboxylate;2,2,2-trifluoroacetic acid
CID 66668148
Methyl 3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylate
CID 57494524
3-Hydroxy-4-oxo-7-piperidin-1-yl-4H-pyrido[1,2-a]pyrimidine-2-carboxylic acid methyl ester
CID 58101059
Methyl 3-hydroxy-9-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylate
CID 58101070
Methyl 3-hydroxy-9-iodo-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylate
CID 58101075
Methyl 3-hydroxy-8-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylate
CID 58101105
7-(Dimethylamino)-3-hydroxy-9-(3-methyl-2-oxoimidazolidin-1-yl)-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid
CID 66667901
methyl 9-acetamido-3-hydroxy-7-morpholino-4-oxo-4H-pyrido[1,2-a]pyrimidine-2-carboxylate
CID 66668109
Methyl 3-hydroxy-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxo-1,3-oxazolidin-3-yl)pyrido[1,2-a]pyrimidine-2-carboxylate
CID 66668149
Methyl-3-acetoxy-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxo-1,3-oxazinan-3-yl)-4H-pyrido[1,2-a]pyrimidine-2-carboxylate
CID 66668160
3-Acetyloxy-6-methyl-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxo-1,3-oxazinan-3-yl)pyrido[1,2-a]pyrimidine-2-carboxylic acid
CID 66668161
methyl 3-hydroxy-7-(4-methylpiperazin-1-yl)-4-oxo-9-(2-oxo-1,3-oxazinan-3-yl)-4H-pyrido[1,2-a]pyrimidine-2-carboxylate
CID 66668215

Frequently Asked Questions

What is the IUPAC name of 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid?
The IUPAC name of 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid (CID 91509902) is 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid?
The canonical SMILES for 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid is CN(C)c1cc(N2CCOCC2)cn2c(=O)c(O)c(C(=O)O)nc12.
What is the InChIKey of 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid?
The InChIKey is WEUANZHRYSSMRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O5/c1-17(2)10-7-9(18-3-5-24-6-4-18)8-19-13(10)16-11(15(22)23)12(20)14(19)21/h7-8,20H,3-6H2,1-2H3,(H,22,23).
What are the key properties of 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid?
9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid has a molecular weight of 334.33 g/mol, XLogP of 0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(dimethylamino)-3-hydroxy-7-morpholin-4-yl-4-oxopyrido[1,2-a]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 91509902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).