1-(6-amino-3-pyridinyl)azetidin-3-ol

C8H11N3O — CID 58043812

IUPAC1-(6-amino-3-pyridinyl)azetidin-3-ol
SMILESNc1ccc(N2CC(O)C2)cn1
InChIInChI=1S/C8H11N3O/c9-8-2-1-6(3-10-8)11-4-7(12)5-11/h1-3,7,12H,4-5H2,(H2,9,10)
InChIKeyAPRJBQHMWFCVLV-UHFFFAOYSA-N
MW165.20 g/mol
LogP-0.16
Rot. Bonds1

About 1-(6-amino-3-pyridinyl)azetidin-3-ol

1-(6-amino-3-pyridinyl)azetidin-3-ol (PubChem CID 58043812) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 1-(6-amino-3-pyridinyl)azetidin-3-ol.

Molecular Properties

Compound Name1-(6-amino-3-pyridinyl)azetidin-3-ol
PubChem CID58043812
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name1-(6-amino-3-pyridinyl)azetidin-3-ol
SMILESNc1ccc(N2CC(O)C2)cn1
InChIInChI=1S/C8H11N3O/c9-8-2-1-6(3-10-8)11-4-7(12)5-11/h1-3,7,12H,4-5H2,(H2,9,10)
InChIKeyAPRJBQHMWFCVLV-UHFFFAOYSA-N
XLogP-0.16
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-3-pyridinyl)azetidin-3-ol?
The IUPAC name of 1-(6-amino-3-pyridinyl)azetidin-3-ol (CID 58043812) is 1-(6-amino-3-pyridinyl)azetidin-3-ol.
What is the SMILES notation for 1-(6-amino-3-pyridinyl)azetidin-3-ol?
The canonical SMILES for 1-(6-amino-3-pyridinyl)azetidin-3-ol is Nc1ccc(N2CC(O)C2)cn1.
What is the InChIKey of 1-(6-amino-3-pyridinyl)azetidin-3-ol?
The InChIKey is APRJBQHMWFCVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c9-8-2-1-6(3-10-8)11-4-7(12)5-11/h1-3,7,12H,4-5H2,(H2,9,10).
What are the key properties of 1-(6-amino-3-pyridinyl)azetidin-3-ol?
1-(6-amino-3-pyridinyl)azetidin-3-ol has a molecular weight of 165.20 g/mol, XLogP of -0.16, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-3-pyridinyl)azetidin-3-ol is sourced from PubChem (CID 58043812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).