1-(4-methylpyrimidin-2-yl)azetidin-3-ol

C8H11N3O — CID 63283961

IUPAC1-(4-methylpyrimidin-2-yl)azetidin-3-ol
SMILESCc1ccnc(N2CC(O)C2)n1
InChIInChI=1S/C8H11N3O/c1-6-2-3-9-8(10-6)11-4-7(12)5-11/h2-3,7,12H,4-5H2,1H3
InChIKeyUDNDQUCYHJWCKO-UHFFFAOYSA-N
MW165.20 g/mol
LogP-0.03
Rot. Bonds1

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

1-(4-methylpyrimidin-2-yl)azetidin-3-ol (PubChem CID 63283961) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 1-(4-methylpyrimidin-2-yl)azetidin-3-ol.

Molecular Properties

Compound Name1-(4-methylpyrimidin-2-yl)azetidin-3-ol
PubChem CID63283961
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name1-(4-methylpyrimidin-2-yl)azetidin-3-ol
SMILESCc1ccnc(N2CC(O)C2)n1
InChIInChI=1S/C8H11N3O/c1-6-2-3-9-8(10-6)11-4-7(12)5-11/h2-3,7,12H,4-5H2,1H3
InChIKeyUDNDQUCYHJWCKO-UHFFFAOYSA-N
XLogP-0.03
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-1-(4-methylpyrimidin-2-yl)pyrrolidin-3-ol
CID 131025799
3-(4-methylpyrimidin-2-yl)-3,6-diazabicyclo[3.2.0]heptane
CID 67086867
N-methyl-1-[1-(4-methylpyrimidin-2-yl)azetidin-3-yl]methanamine
CID 130921522
4-hydroxy-1-(4-methylpyrimidin-2-yl)pyrrolidine-2-carboxylic acid
CID 62959062
ethane;4-methyl-2-pyrrolidin-1-ylpyrimidine
CID 178079017
4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine
CID 15132532
1-pyrimidin-2-ylazetidin-3-ol;hydrochloride
CID 155858524
2-(3,4-dimethylpiperazin-1-yl)-4-methylpyrimidine
CID 123999488
4-methyl-2-(3-methylpiperidin-1-yl)pyrimidine
CID 89079553
N,N-dimethyl-1-(4-methylpyrimidin-2-yl)pyrrolidin-3-amine
CID 123144666
4-methyl-2-(3-methylpiperazin-1-yl)pyrimidine;hydrochloride
CID 71639412
2-[1-(4-methylpyrimidin-2-yl)pyrrolidin-3-yl]ethanol
CID 115657972

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpyrimidin-2-yl)azetidin-3-ol?
The IUPAC name of 1-(4-methylpyrimidin-2-yl)azetidin-3-ol (CID 63283961) is 1-(4-methylpyrimidin-2-yl)azetidin-3-ol.
What is the SMILES notation for 1-(4-methylpyrimidin-2-yl)azetidin-3-ol?
The canonical SMILES for 1-(4-methylpyrimidin-2-yl)azetidin-3-ol is Cc1ccnc(N2CC(O)C2)n1.
What is the InChIKey of 1-(4-methylpyrimidin-2-yl)azetidin-3-ol?
The InChIKey is UDNDQUCYHJWCKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-6-2-3-9-8(10-6)11-4-7(12)5-11/h2-3,7,12H,4-5H2,1H3.
What are the key properties of 1-(4-methylpyrimidin-2-yl)azetidin-3-ol?
1-(4-methylpyrimidin-2-yl)azetidin-3-ol has a molecular weight of 165.20 g/mol, XLogP of -0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpyrimidin-2-yl)azetidin-3-ol is sourced from PubChem (CID 63283961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).