1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol

C10H13N3O — CID 126850197

IUPAC1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol
SMILESOC1CN(c2cc(C3CC3)ncn2)C1
InChIInChI=1S/C10H13N3O/c14-8-4-13(5-8)10-3-9(7-1-2-7)11-6-12-10/h3,6-8,14H,1-2,4-5H2
InChIKeyWKMMEEBTYMNZKL-UHFFFAOYSA-N
MW191.23 g/mol
LogP0.53
Rot. Bonds2

About 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol

1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol (PubChem CID 126850197) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol.

Molecular Properties

Compound Name1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol
PubChem CID126850197
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol
SMILESOC1CN(c2cc(C3CC3)ncn2)C1
InChIInChI=1S/C10H13N3O/c14-8-4-13(5-8)10-3-9(7-1-2-7)11-6-12-10/h3,6-8,14H,1-2,4-5H2
InChIKeyWKMMEEBTYMNZKL-UHFFFAOYSA-N
XLogP0.53
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-cyclopropylpyrimidin-4-yl)piperidin-4-ol
CID 126850200
[1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-yl]methanamine
CID 126848081
[1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-yl]-pyrrolidin-1-ylmethanone
CID 165434882
3-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]cyclobutan-1-ol
CID 91770488
5-(6-cyclopropylpyrimidin-4-yl)-2-(6-methylpyridazin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 126858092
4-cyclobutyl-6-(3-fluoropiperidin-1-yl)pyrimidine
CID 172880704
[1-(6-cyclohexylpyrimidin-4-yl)azetidin-3-yl]methanamine
CID 141272664
[(3R,5S)-1-(6-cyclopropylpyrimidin-4-yl)-5-[(dimethylamino)methyl]piperidin-3-yl]methanol
CID 133111471
1-[6-(methylamino)pyrimidin-4-yl]azetidin-3-ol
CID 121206025
3-cyclopropyl-6-[4-(6-cyclopropylpyrimidin-4-yl)piperazin-1-yl]pyridazine
CID 122279677
[2-(6-cyclopropylpyrimidin-4-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-(oxan-4-yl)methanone
CID 126932633
3-[6-(4-pyridin-4-ylpiperidin-1-yl)pyrimidin-4-yl]cyclobutan-1-ol
CID 91772623

Frequently Asked Questions

What is the IUPAC name of 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol?
The IUPAC name of 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol (CID 126850197) is 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol.
What is the SMILES notation for 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol?
The canonical SMILES for 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol is OC1CN(c2cc(C3CC3)ncn2)C1.
What is the InChIKey of 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol?
The InChIKey is WKMMEEBTYMNZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c14-8-4-13(5-8)10-3-9(7-1-2-7)11-6-12-10/h3,6-8,14H,1-2,4-5H2.
What are the key properties of 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol?
1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol has a molecular weight of 191.23 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-cyclopropylpyrimidin-4-yl)azetidin-3-ol is sourced from PubChem (CID 126850197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).