6-(oxetan-3-yloxymethyl)pyridin-3-amine

C9H12N2O2 — CID 164650647

IUPAC6-(oxetan-3-yloxymethyl)pyridin-3-amine
SMILESNc1ccc(COC2COC2)nc1
InChIInChI=1S/C9H12N2O2/c10-7-1-2-8(11-3-7)4-13-9-5-12-6-9/h1-3,9H,4-6,10H2
InChIKeyBTKAGGDRZJQMMC-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.58
Rot. Bonds3

About 6-(oxetan-3-yloxymethyl)pyridin-3-amine

6-(oxetan-3-yloxymethyl)pyridin-3-amine (PubChem CID 164650647) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 6-(oxetan-3-yloxymethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-(oxetan-3-yloxymethyl)pyridin-3-amine
PubChem CID164650647
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name6-(oxetan-3-yloxymethyl)pyridin-3-amine
SMILESNc1ccc(COC2COC2)nc1
InChIInChI=1S/C9H12N2O2/c10-7-1-2-8(11-3-7)4-13-9-5-12-6-9/h1-3,9H,4-6,10H2
InChIKeyBTKAGGDRZJQMMC-UHFFFAOYSA-N
XLogP0.58
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-3-(oxetan-3-yloxymethyl)aniline
CID 102605525
6-(3-methylbutyl)pyridin-3-amine
CID 82414791
5-bromo-6-(oxetan-3-yloxy)pyridin-3-amine
CID 102605464
[3-(oxetan-3-yloxymethyl)phenyl]methanamine
CID 102605746
6-[2-(3-methylmorpholin-4-yl)ethyl]pyridin-3-amine
CID 107340051
2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
5-chloro-2-(oxetan-3-yloxymethyl)aniline
CID 102605621
5-(cyclobutyloxymethyl)pyrazin-2-amine
CID 103058850
5-bromo-2-(piperidin-4-yloxymethyl)pyridine
CID 104799559
6-[2-(4-methoxypiperidin-1-yl)ethyl]pyridin-3-amine
CID 107340047
[4-[[(3S)-oxolan-3-yl]oxymethyl]pyrimidin-2-yl]methanamine
CID 142707797
oxolan-3-yl 5-aminopyridine-2-carboxylate
CID 81316831

Frequently Asked Questions

What is the IUPAC name of 6-(oxetan-3-yloxymethyl)pyridin-3-amine?
The IUPAC name of 6-(oxetan-3-yloxymethyl)pyridin-3-amine (CID 164650647) is 6-(oxetan-3-yloxymethyl)pyridin-3-amine.
What is the SMILES notation for 6-(oxetan-3-yloxymethyl)pyridin-3-amine?
The canonical SMILES for 6-(oxetan-3-yloxymethyl)pyridin-3-amine is Nc1ccc(COC2COC2)nc1.
What is the InChIKey of 6-(oxetan-3-yloxymethyl)pyridin-3-amine?
The InChIKey is BTKAGGDRZJQMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c10-7-1-2-8(11-3-7)4-13-9-5-12-6-9/h1-3,9H,4-6,10H2.
What are the key properties of 6-(oxetan-3-yloxymethyl)pyridin-3-amine?
6-(oxetan-3-yloxymethyl)pyridin-3-amine has a molecular weight of 180.21 g/mol, XLogP of 0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(oxetan-3-yloxymethyl)pyridin-3-amine is sourced from PubChem (CID 164650647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).