4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one

C10H15N3O2 — CID 105462847

IUPAC4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1nc(C2CCNC2)[nH]c(=O)c1C
InChIInChI=1S/C10H15N3O2/c1-6-9(14)12-8(13-10(6)15-2)7-3-4-11-5-7/h7,11H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyASYTZQLQRWDJNX-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.16
Rot. Bonds2

About 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one

4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one (PubChem CID 105462847) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
PubChem CID105462847
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
SMILESCOc1nc(C2CCNC2)[nH]c(=O)c1C
InChIInChI=1S/C10H15N3O2/c1-6-9(14)12-8(13-10(6)15-2)7-3-4-11-5-7/h7,11H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyASYTZQLQRWDJNX-UHFFFAOYSA-N
XLogP0.16
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
CID 84656984
4-methoxy-5-methyl-2-(methylaminomethyl)-1H-pyrimidin-6-one
CID 105440514
2-(2-aminoethyl)-4-methoxy-5-methyl-1H-pyrimidin-6-one
CID 105440521
4-hydroxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
CID 105448884
4-methoxy-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
CID 105448885
2-(2-aminopropyl)-4-methoxy-5-methyl-1H-pyrimidin-6-one
CID 105450681
2-(3-aminopropyl)-4-methoxy-5-methyl-1H-pyrimidin-6-one
CID 105450687
4-hydroxy-5-methyl-2-(pyrrolidin-3-ylmethyl)-1H-pyrimidin-6-one
CID 105462839
4-methoxy-2-(pyrrolidin-3-ylmethyl)-1H-pyrimidin-6-one
CID 105462840
4-methoxy-5-methyl-2-[3-(methylamino)propyl]-1H-pyrimidin-6-one
CID 105465050
4-methoxy-5-methyl-2-(pyrrolidin-3-ylmethyl)-1H-pyrimidin-6-one
CID 105480515
4-methoxy-5-methyl-2-(pyrrolidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 105480516

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one (CID 105462847) is 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one is COc1nc(C2CCNC2)[nH]c(=O)c1C.
What is the InChIKey of 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one?
The InChIKey is ASYTZQLQRWDJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-6-9(14)12-8(13-10(6)15-2)7-3-4-11-5-7/h7,11H,3-5H2,1-2H3,(H,12,13,14).
What are the key properties of 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one?
4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-methyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 105462847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).