2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine

C16H19N3O — CID 62911300

IUPAC2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine
SMILESNc1cccnc1OC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C16H19N3O/c17-15-7-4-9-18-16(15)20-14-8-10-19(12-14)11-13-5-2-1-3-6-13/h1-7,9,14H,8,10-12,17H2
InChIKeyXJGJPXLWBJDPET-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.32
Rot. Bonds4

About 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine

2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine (PubChem CID 62911300) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine.

Molecular Properties

Compound Name2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine
PubChem CID62911300
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine
SMILESNc1cccnc1OC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C16H19N3O/c17-15-7-4-9-18-16(15)20-14-8-10-19(12-14)11-13-5-2-1-3-6-13/h1-7,9,14H,8,10-12,17H2
InChIKeyXJGJPXLWBJDPET-UHFFFAOYSA-N
XLogP2.32
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(1-benzylpyrrolidin-3-yl)oxypyrazin-2-yl]methanamine
CID 62911298
2-(1-benzylpyrrolidin-3-yl)oxy-6-chloropyridin-3-amine
CID 115474532
2-(1-benzylpyrrolidin-3-yl)oxy-5-methylpyridin-3-amine
CID 66281326
4-(1-benzylpyrrolidin-3-yl)oxy-5-bromopyrimidin-2-amine
CID 80879763
2-(1-benzylpyrrolidin-3-yl)oxy-5-bromopyridine
CID 62918212
O-(1-benzylpyrrolidin-3-yl)hydroxylamine;hydrochloride
CID 142714057
(3R)-1-benzyl-3-methoxypyrrolidine
CID 157327886
6-(1-benzylpyrrolidin-3-yl)oxy-7-methylisoquinolin-1-amine
CID 68875331
4-(1-benzylpyrrolidin-3-yl)oxy-3-fluoroaniline
CID 62916163
4-(1-benzylpyrrolidin-3-yl)oxy-3-bromoaniline
CID 62916334
8-(1-benzylpyrrolidin-3-yl)oxyquinolin-2-amine
CID 22254574
2-[(3S)-1-benzylpyrrolidin-3-yl]oxyethanamine
CID 94894903

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine?
The IUPAC name of 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine (CID 62911300) is 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine.
What is the SMILES notation for 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine?
The canonical SMILES for 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine is Nc1cccnc1OC1CCN(Cc2ccccc2)C1.
What is the InChIKey of 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine?
The InChIKey is XJGJPXLWBJDPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c17-15-7-4-9-18-16(15)20-14-8-10-19(12-14)11-13-5-2-1-3-6-13/h1-7,9,14H,8,10-12,17H2.
What are the key properties of 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine?
2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine has a molecular weight of 269.35 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylpyrrolidin-3-yl)oxypyridin-3-amine is sourced from PubChem (CID 62911300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).