6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one

C12H20N4O3 — CID 11594190

IUPAC6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1CCCN1CCOCC1
InChIInChI=1S/C12H20N4O3/c1-18-12-14-10(13)9-11(17)16(12)4-2-3-15-5-7-19-8-6-15/h9H,2-8,13H2,1H3
InChIKeyXSAGZIUDLYZEDS-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.44
Rot. Bonds5

About 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one

6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one (PubChem CID 11594190) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one.

Molecular Properties

Compound Name6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one
PubChem CID11594190
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1CCCN1CCOCC1
InChIInChI=1S/C12H20N4O3/c1-18-12-14-10(13)9-11(17)16(12)4-2-3-15-5-7-19-8-6-15/h9H,2-8,13H2,1H3
InChIKeyXSAGZIUDLYZEDS-UHFFFAOYSA-N
XLogP-0.44
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(dimethylamino)-6-morpholinopyrimidin-4(3H)-one
CID 136188794
1,3-Dimethyl-6-(morpholinomethyleneamino)pyrimidine-2,4-dione
CID 101563465
4-Morpholin-4-yl-6-oxopyrimidine-1-carboxamide
CID 123522893
6-Amino-2-methoxy-3-[2-(2-methoxyethoxy)ethyl]-4-pyrimidone
CID 11492462
2,6-Diamino-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525147
2-Amino-6-(dimethylamino)-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525155
6-Amino-3-(2-ethoxyethyl)pyrimidin-4-one
CID 23525168
6-Amino-2-methyl-3-(2-propoxyethyl)pyrimidin-4-one
CID 59073654
6-Amino-2-methoxy-3-[2-(2-morpholin-4-ylethoxy)ethyl]pyrimidin-4-one
CID 91318119
1-Methyl-2-(2-morpholin-4-ylethyl)-6-oxopyrimidine-4-carboxamide
CID 150229737
N-(1-methyl-4-morpholin-4-yl-6-oxopyrimidin-2-yl)acetamide
CID 153863600
2-(Ethylamino)-6-morpholin-4-yl-3-propylpyrimidin-4-one
CID 160654602

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one?
The IUPAC name of 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one (CID 11594190) is 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one.
What is the SMILES notation for 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one?
The canonical SMILES for 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one is COc1nc(N)cc(=O)n1CCCN1CCOCC1.
What is the InChIKey of 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one?
The InChIKey is XSAGZIUDLYZEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-18-12-14-10(13)9-11(17)16(12)4-2-3-15-5-7-19-8-6-15/h9H,2-8,13H2,1H3.
What are the key properties of 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one?
6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one has a molecular weight of 268.32 g/mol, XLogP of -0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methoxy-3-(3-morpholin-4-ylpropyl)pyrimidin-4-one is sourced from PubChem (CID 11594190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).