3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine

C17H20N2O — CID 169279292

IUPAC3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine
SMILESCN1CCC(c2ccccc2)[C@@H]1COc1cccnc1
InChIInChI=1S/C17H20N2O/c1-19-11-9-16(14-6-3-2-4-7-14)17(19)13-20-15-8-5-10-18-12-15/h2-8,10,12,16-17H,9,11,13H2,1H3/t16?,17-/m0/s1
InChIKeyDBZXRWDSRXNTQM-DJNXLDHESA-N
MW268.36 g/mol
LogP2.95
Rot. Bonds4

About 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine

3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine (PubChem CID 169279292) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine.

Molecular Properties

Compound Name3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine
PubChem CID169279292
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine
SMILESCN1CCC(c2ccccc2)[C@@H]1COc1cccnc1
InChIInChI=1S/C17H20N2O/c1-19-11-9-16(14-6-3-2-4-7-14)17(19)13-20-15-8-5-10-18-12-15/h2-8,10,12,16-17H,9,11,13H2,1H3/t16?,17-/m0/s1
InChIKeyDBZXRWDSRXNTQM-DJNXLDHESA-N
XLogP2.95
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 ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine?
The IUPAC name of 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine (CID 169279292) is 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine.
What is the SMILES notation for 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine?
The canonical SMILES for 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine is CN1CCC(c2ccccc2)[C@@H]1COc1cccnc1.
What is the InChIKey of 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine?
The InChIKey is DBZXRWDSRXNTQM-DJNXLDHESA-N. The full InChI is InChI=1S/C17H20N2O/c1-19-11-9-16(14-6-3-2-4-7-14)17(19)13-20-15-8-5-10-18-12-15/h2-8,10,12,16-17H,9,11,13H2,1H3/t16?,17-/m0/s1.
What are the key properties of 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine?
3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine has a molecular weight of 268.36 g/mol, XLogP of 2.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2R)-1-methyl-3-phenylpyrrolidin-2-yl]methoxy]pyridine is sourced from PubChem (CID 169279292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).