7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid

C11H12N4O3 — CID 56648965

IUPAC7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid
SMILESO=C(O)c1cnc2nc(N3CCOCC3)ccn12
InChIInChI=1S/C11H12N4O3/c16-10(17)8-7-12-11-13-9(1-2-15(8)11)14-3-5-18-6-4-14/h1-2,7H,3-6H2,(H,16,17)
InChIKeyPCQXVCPNMJZHDW-UHFFFAOYSA-N
MW248.24 g/mol
LogP0.26
Rot. Bonds2

About 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid

7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid (PubChem CID 56648965) has the molecular formula C11H12N4O3 and a molecular weight of 248.24 g/mol. Its IUPAC name is 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid.

Molecular Properties

Compound Name7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid
PubChem CID56648965
Molecular FormulaC11H12N4O3
Molecular Weight248.24 g/mol
Exact Mass248.09
IUPAC Name7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid
SMILESO=C(O)c1cnc2nc(N3CCOCC3)ccn12
InChIInChI=1S/C11H12N4O3/c16-10(17)8-7-12-11-13-9(1-2-15(8)11)14-3-5-18-6-4-14/h1-2,7H,3-6H2,(H,16,17)
InChIKeyPCQXVCPNMJZHDW-UHFFFAOYSA-N
XLogP0.26
TPSA79.96 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-[7-(hydroxymethyl)-5-azaspiro[3.4]octan-5-yl]imidazo[1,2-a]pyrimidine-3-carboxylic acid
CID 167753096
5-(1,4-oxazepan-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 146599734
2-methyl-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 67287742
methyl 4-morpholin-4-ylpyrimidine-2-carboxylate
CID 150936080
morpholin-4-yl-(6-morpholin-4-yl-2-pyridinyl)methanone
CID 84575028
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
N-(2-morpholin-4-yl-5-oxopyrido[4,3-d]pyrimidin-6-yl)acetamide
CID 17198708
(6-morpholin-4-yl-2-pyridinyl)-(4-phenylpiperazin-1-yl)methanone
CID 84574001
4-(7-propylimidazo[1,2-a]pyrimidin-3-yl)morpholine
CID 134848593
2-(6-morpholin-4-yl-2-pyridinyl)propanoic acid
CID 83897074
1-[5-(1,4-oxazepan-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl]ethanone
CID 157339662
ethane;1-(6-morpholin-4-yl-3-pyridinyl)ethanone
CID 145421407

Frequently Asked Questions

What is the IUPAC name of 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The IUPAC name of 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid (CID 56648965) is 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid.
What is the SMILES notation for 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The canonical SMILES for 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid is O=C(O)c1cnc2nc(N3CCOCC3)ccn12.
What is the InChIKey of 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid?
The InChIKey is PCQXVCPNMJZHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O3/c16-10(17)8-7-12-11-13-9(1-2-15(8)11)14-3-5-18-6-4-14/h1-2,7H,3-6H2,(H,16,17).
What are the key properties of 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid?
7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid has a molecular weight of 248.24 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-morpholin-4-ylimidazo[1,2-a]pyrimidine-3-carboxylic acid is sourced from PubChem (CID 56648965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).