4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one

C11H15N3O3 — CID 83870267

IUPAC4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one
SMILESO=c1nc(C2COCCN2)c2c([nH]1)CCOC2
InChIInChI=1S/C11H15N3O3/c15-11-13-8-1-3-16-5-7(8)10(14-11)9-6-17-4-2-12-9/h9,12H,1-6H2,(H,13,14,15)
InChIKeyGPEVTELDBUPUQR-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.50
Rot. Bonds1

About 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one

4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one (PubChem CID 83870267) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one
PubChem CID83870267
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one
SMILESO=c1nc(C2COCCN2)c2c([nH]1)CCOC2
InChIInChI=1S/C11H15N3O3/c15-11-13-8-1-3-16-5-7(8)10(14-11)9-6-17-4-2-12-9/h9,12H,1-6H2,(H,13,14,15)
InChIKeyGPEVTELDBUPUQR-UHFFFAOYSA-N
XLogP-0.50
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(1S)-1-aminoethyl]-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one
CID 83859004
3-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)morpholine
CID 83858881
2-(2-oxo-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-4-yl)propanoic acid
CID 83859012
4-(oxan-3-yl)-5,6,7,8-tetrahydro-1H-pyrido[3,4-d]pyrimidin-2-one
CID 83850759
3-pyrrolidin-2-yl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
CID 83847308
2-oxo-5,6,8,9-tetrahydro-1H-oxepino[4,5-d]pyrimidine-4-carbaldehyde
CID 83862991
2,4-dimethyl-5-morpholin-3-yl-1H-pyrimidin-6-one
CID 136921530
2-oxo-5,6,8,9-tetrahydro-1H-oxepino[4,5-d]pyrimidine-4-carboxylic acid
CID 83862867
(3S)-3-(3,6-difluoro-2-pyridinyl)morpholine
CID 130648555
4-methyl-3,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one
CID 105432959
3-(4-chloro-1,2,5-thiadiazol-3-yl)morpholine
CID 174874071
3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
CID 75355392

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one?
The IUPAC name of 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one (CID 83870267) is 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one.
What is the SMILES notation for 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one?
The canonical SMILES for 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one is O=c1nc(C2COCCN2)c2c([nH]1)CCOC2.
What is the InChIKey of 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one?
The InChIKey is GPEVTELDBUPUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c15-11-13-8-1-3-16-5-7(8)10(14-11)9-6-17-4-2-12-9/h9,12H,1-6H2,(H,13,14,15).
What are the key properties of 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one?
4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one has a molecular weight of 237.26 g/mol, XLogP of -0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-3-yl-1,5,7,8-tetrahydropyrano[4,3-d]pyrimidin-2-one is sourced from PubChem (CID 83870267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).