3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine

C17H20N2O — CID 102539504

IUPAC3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine
SMILESCN1CCCC1c1cccnc1OCc1ccccc1
InChIInChI=1S/C17H20N2O/c1-19-12-6-10-16(19)15-9-5-11-18-17(15)20-13-14-7-3-2-4-8-14/h2-5,7-9,11,16H,6,10,12-13H2,1H3
InChIKeyVGQAMJJNAUPNBL-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.43
Rot. Bonds4

About 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine

3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine (PubChem CID 102539504) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine.

Molecular Properties

Compound Name3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine
PubChem CID102539504
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine
SMILESCN1CCCC1c1cccnc1OCc1ccccc1
InChIInChI=1S/C17H20N2O/c1-19-12-6-10-16(19)15-9-5-11-18-17(15)20-13-14-7-3-2-4-8-14/h2-5,7-9,11,16H,6,10,12-13H2,1H3
InChIKeyVGQAMJJNAUPNBL-UHFFFAOYSA-N
XLogP3.43
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-phenylmethoxy-3-pyridinyl)pyrrolidin-1-yl]ethanone
CID 102539508
2-[[3-[(2S)-1-methylpyrrolidin-2-yl]-2-pyridinyl]oxy]ethanamine
CID 54675477
3-cyclooctyl-2-phenylmethoxypyridine
CID 163522347
2-ethoxy-3-(1-propylpyrrolidin-2-yl)pyridine
CID 102539384
2-phenylmethoxy-3-piperidin-2-ylpyridine
CID 102539518
3-(1-methylpyrrolidin-2-yl)pyridine-2-carbaldehyde
CID 174681214
2-hydroxypropanoic acid;2-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174226141
2-(1-methylpyrrolidin-2-yl)pyrimidine
CID 89060530
3-(1-ethylpiperidin-2-yl)-2-methoxypyridine
CID 102539330
1-methyl-2-oxo-N-(2-phenylmethoxy-3-pyridinyl)piperidine-4-carboxamide
CID 75461391
4-[3-(1-methylpiperidin-2-yl)-2-pyridinyl]morpholine
CID 102541606
3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridin-2-ylpyridine
CID 59522846

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine?
The IUPAC name of 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine (CID 102539504) is 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine.
What is the SMILES notation for 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine?
The canonical SMILES for 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine is CN1CCCC1c1cccnc1OCc1ccccc1.
What is the InChIKey of 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine?
The InChIKey is VGQAMJJNAUPNBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-19-12-6-10-16(19)15-9-5-11-18-17(15)20-13-14-7-3-2-4-8-14/h2-5,7-9,11,16H,6,10,12-13H2,1H3.
What are the key properties of 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine?
3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine has a molecular weight of 268.36 g/mol, XLogP of 3.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrrolidin-2-yl)-2-phenylmethoxypyridine is sourced from PubChem (CID 102539504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).