4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one

C10H15N3O2 — CID 103241431

IUPAC4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
SMILESO=c1cc(OCCN2CCCC2)nc[nH]1
InChIInChI=1S/C10H15N3O2/c14-9-7-10(12-8-11-9)15-6-5-13-3-1-2-4-13/h7-8H,1-6H2,(H,11,12,14)
InChIKeyFEEPEULUBOXMAD-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.24
Rot. Bonds4

About 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one

4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one (PubChem CID 103241431) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
PubChem CID103241431
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
SMILESO=c1cc(OCCN2CCCC2)nc[nH]1
InChIInChI=1S/C10H15N3O2/c14-9-7-10(12-8-11-9)15-6-5-13-3-1-2-4-13/h7-8H,1-6H2,(H,11,12,14)
InChIKeyFEEPEULUBOXMAD-UHFFFAOYSA-N
XLogP0.24
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(R)-6-(Pyrrolidin-3-yloxy)pyrimidin-4-ol hydrochloride
CID 66569893
4-[(3R)-pyrrolidin-3-yl]oxy-1H-pyrimidin-6-one
CID 66569894
4-[2-[cyclopropyl(methyl)amino]ethoxy]-1H-pyrimidin-6-one
CID 102741500
4-[2-(dimethylamino)ethoxy]-1H-pyrimidin-6-one
CID 103241383
4-(2-piperidin-1-ylethoxy)-1H-pyrimidin-6-one
CID 103241394
4-[2-(diethylamino)ethoxy]-1H-pyrimidin-6-one
CID 103241419
5-methoxy-4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
CID 103241428
2-methyl-4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
CID 103241429
4-[3-(dimethylamino)propoxy]-1H-pyrimidin-6-one
CID 103241445
2-ethyl-4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one
CID 113792732
4-[2-[di(propan-2-yl)amino]ethoxy]-1H-pyrimidin-6-one
CID 113792798
4-(pyrrolidin-2-ylmethoxy)-1H-pyrimidin-6-one
CID 114586288

Frequently Asked Questions

What is the IUPAC name of 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one?
The IUPAC name of 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one (CID 103241431) is 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one?
The canonical SMILES for 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one is O=c1cc(OCCN2CCCC2)nc[nH]1.
What is the InChIKey of 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one?
The InChIKey is FEEPEULUBOXMAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c14-9-7-10(12-8-11-9)15-6-5-13-3-1-2-4-13/h7-8H,1-6H2,(H,11,12,14).
What are the key properties of 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one?
4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one has a molecular weight of 209.25 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyrrolidin-1-ylethoxy)-1H-pyrimidin-6-one is sourced from PubChem (CID 103241431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).