3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol

C11H17N3O2 — CID 146128971

IUPAC3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol
SMILESCCC1(O)CN(c2nc(C)cc(OC)n2)C1
InChIInChI=1S/C11H17N3O2/c1-4-11(15)6-14(7-11)10-12-8(2)5-9(13-10)16-3/h5,15H,4,6-7H2,1-3H3
InChIKeyCJEWVXWFMCEYRU-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.75
Rot. Bonds3

About 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol

3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol (PubChem CID 146128971) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol.

Molecular Properties

Compound Name3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol
PubChem CID146128971
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol
SMILESCCC1(O)CN(c2nc(C)cc(OC)n2)C1
InChIInChI=1S/C11H17N3O2/c1-4-11(15)6-14(7-11)10-12-8(2)5-9(13-10)16-3/h5,15H,4,6-7H2,1-3H3
InChIKeyCJEWVXWFMCEYRU-UHFFFAOYSA-N
XLogP0.75
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4,6-dimethoxypyrimidin-2-yl)-3-ethylazetidin-3-ol
CID 113293020
3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-amine
CID 112635867
4-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxylic acid
CID 115973034
1-(4,6-dimethoxypyrimidin-2-yl)-3-methylazetidin-3-ol
CID 115355462
3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)piperidine-3-carboxylic acid
CID 115973040
4-(4-fluorophenyl)-1-(4-methoxy-6-methylpyrimidin-2-yl)piperidin-4-ol
CID 3228710
2-[4-(4-methoxy-6-methylpyrimidin-2-yl)-1,4-diazepan-1-yl]ethanol
CID 146132286
[1-(4-methoxy-6-methylpyrimidin-2-yl)-4-methylsulfanylpiperidin-4-yl]methanamine
CID 112634707
1-[1-(4-methoxy-6-methylpyrimidin-2-yl)piperidin-4-yl]-N-methylmethanamine
CID 112634860
2-[4-(1-bromoethyl)piperidin-1-yl]-4-methoxy-6-methylpyrimidine
CID 106838651
4-methoxy-6-methyl-2-[(3R)-3-methylpiperazin-1-yl]pyrimidine
CID 104976163
1-(4,6-dimethoxypyrimidin-2-yl)-3-ethylpyrrolidine-3-carboxylic acid
CID 115354743

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol?
The IUPAC name of 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol (CID 146128971) is 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol.
What is the SMILES notation for 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol?
The canonical SMILES for 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol is CCC1(O)CN(c2nc(C)cc(OC)n2)C1.
What is the InChIKey of 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol?
The InChIKey is CJEWVXWFMCEYRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-4-11(15)6-14(7-11)10-12-8(2)5-9(13-10)16-3/h5,15H,4,6-7H2,1-3H3.
What are the key properties of 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol?
3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol has a molecular weight of 223.28 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(4-methoxy-6-methylpyrimidin-2-yl)azetidin-3-ol is sourced from PubChem (CID 146128971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).