3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol

C10H16N2O3 — CID 102927713

IUPAC3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol
SMILESCOCCOCCC(O)c1cncnc1
InChIInChI=1S/C10H16N2O3/c1-14-4-5-15-3-2-10(13)9-6-11-8-12-7-9/h6-8,10,13H,2-5H2,1H3
InChIKeyQPLAEQVFZATMEA-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.56
Rot. Bonds7

About 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol

3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol (PubChem CID 102927713) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol
PubChem CID102927713
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol
SMILESCOCCOCCC(O)c1cncnc1
InChIInChI=1S/C10H16N2O3/c1-14-4-5-15-3-2-10(13)9-6-11-8-12-7-9/h6-8,10,13H,2-5H2,1H3
InChIKeyQPLAEQVFZATMEA-UHFFFAOYSA-N
XLogP0.56
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methoxy-3-methyl-1-pyrimidin-5-ylbutan-1-ol
CID 105083775
1-pyrimidin-5-ylhexan-1-ol
CID 15889672
6-methyl-1-pyrimidin-5-ylheptan-1-ol
CID 174530824
1-pyrimidin-5-ylheptan-1-ol
CID 63901616
(1S)-1-pyrimidin-5-ylpropan-1-ol
CID 15812275
3-(2-methoxyethoxy)-1-(3-propan-2-yloxyphenyl)propan-1-ol
CID 102927565
1-(4-cyclopropyloxyphenyl)-3-(2-methoxyethoxy)propan-1-ol
CID 102927747
1-(5-fluoro-3-pyridinyl)-3-propoxypropan-1-ol
CID 105080397
4-(2-methoxyethoxy)butan-2-ol
CID 21045149
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-3-(2-methoxyethoxy)propan-1-ol
CID 102927629
1-(4-chloro-1-propylpyrazol-5-yl)-3-(2-methoxyethoxy)propan-1-ol
CID 102927699
1-(2,3-dichlorophenyl)-3-(2-methoxyethoxy)propan-1-ol
CID 102927602

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol?
The IUPAC name of 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol (CID 102927713) is 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol.
What is the SMILES notation for 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol?
The canonical SMILES for 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol is COCCOCCC(O)c1cncnc1.
What is the InChIKey of 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol?
The InChIKey is QPLAEQVFZATMEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-14-4-5-15-3-2-10(13)9-6-11-8-12-7-9/h6-8,10,13H,2-5H2,1H3.
What are the key properties of 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol?
3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol has a molecular weight of 212.25 g/mol, XLogP of 0.56, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-1-pyrimidin-5-ylpropan-1-ol is sourced from PubChem (CID 102927713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).