5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one

C10H15N3O — CID 84664920

IUPAC5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
SMILESCCc1cnc(C2CCCN2)[nH]c1=O
InChIInChI=1S/C10H15N3O/c1-2-7-6-12-9(13-10(7)14)8-4-3-5-11-8/h6,8,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyMTKZIEXBMNDPJY-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.76
Rot. Bonds2

About 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one

5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one (PubChem CID 84664920) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
PubChem CID84664920
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
SMILESCCc1cnc(C2CCCN2)[nH]c1=O
InChIInChI=1S/C10H15N3O/c1-2-7-6-12-9(13-10(7)14)8-4-3-5-11-8/h6,8,11H,2-5H2,1H3,(H,12,13,14)
InChIKeyMTKZIEXBMNDPJY-UHFFFAOYSA-N
XLogP0.76
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-2-pyrrolidin-3-yl-1H-pyrimidin-6-one
CID 84664919
2-[3-(ethylamino)propyl]-5-propyl-1H-pyrimidin-6-one
CID 144503930
5-methyl-2-[(propan-2-ylamino)methyl]-1H-pyrimidin-6-one
CID 148774555
5-ethyl-2-(1-piperidin-4-ylpyrrolidin-3-yl)-1H-pyrimidin-6-one
CID 169149103
2-(Pyrrolidin-2-yl)pyrimidin-4-ol
CID 63362689
5-ethyl-4-hydroxy-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
CID 63555350
4-hydroxy-5-propyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
CID 63555351
4-hydroxy-5-propan-2-yl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
CID 63555352
4-hydroxy-5-methyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
CID 63555695
2-(aminomethyl)-5-ethyl-1H-pyrimidin-6-one
CID 84649771
5-ethyl-2-(methylaminomethyl)-1H-pyrimidin-6-one
CID 84652723
5-methyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one
CID 84656985

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one (CID 84664920) is 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one is CCc1cnc(C2CCCN2)[nH]c1=O.
What is the InChIKey of 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one?
The InChIKey is MTKZIEXBMNDPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-7-6-12-9(13-10(7)14)8-4-3-5-11-8/h6,8,11H,2-5H2,1H3,(H,12,13,14).
What are the key properties of 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one?
5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-pyrrolidin-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 84664920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).