1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol

C10H15N3O — CID 130991793

IUPAC1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol
SMILESCNc1ccc(CN2CC(O)C2)cn1
InChIInChI=1S/C10H15N3O/c1-11-10-3-2-8(4-12-10)5-13-6-9(14)7-13/h2-4,9,14H,5-7H2,1H3,(H,11,12)
InChIKeyGSKCIQUWSADDIH-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.30
Rot. Bonds3

About 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol

1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol (PubChem CID 130991793) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol.

Molecular Properties

Compound Name1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol
PubChem CID130991793
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol
SMILESCNc1ccc(CN2CC(O)C2)cn1
InChIInChI=1S/C10H15N3O/c1-11-10-3-2-8(4-12-10)5-13-6-9(14)7-13/h2-4,9,14H,5-7H2,1H3,(H,11,12)
InChIKeyGSKCIQUWSADDIH-UHFFFAOYSA-N
XLogP0.30
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol?
The IUPAC name of 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol (CID 130991793) is 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol.
What is the SMILES notation for 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol?
The canonical SMILES for 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol is CNc1ccc(CN2CC(O)C2)cn1.
What is the InChIKey of 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol?
The InChIKey is GSKCIQUWSADDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-11-10-3-2-8(4-12-10)5-13-6-9(14)7-13/h2-4,9,14H,5-7H2,1H3,(H,11,12).
What are the key properties of 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol?
1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol has a molecular weight of 193.25 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[6-(methylamino)-3-pyridinyl]methyl]azetidin-3-ol is sourced from PubChem (CID 130991793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).