2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine

C13H20N2O — CID 153376606

IUPAC2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine
SMILESCc1cc(OC[C@@]2(C)CCNC2)cc(C)n1
InChIInChI=1S/C13H20N2O/c1-10-6-12(7-11(2)15-10)16-9-13(3)4-5-14-8-13/h6-7,14H,4-5,8-9H2,1-3H3/t13-/m0/s1
InChIKeyMVJLNCXMAZFZJY-ZDUSSCGKSA-N
MW220.32 g/mol
LogP2.08
Rot. Bonds3

About 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine

2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine (PubChem CID 153376606) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine.

Molecular Properties

Compound Name2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine
PubChem CID153376606
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine
SMILESCc1cc(OC[C@@]2(C)CCNC2)cc(C)n1
InChIInChI=1S/C13H20N2O/c1-10-6-12(7-11(2)15-10)16-9-13(3)4-5-14-8-13/h6-7,14H,4-5,8-9H2,1-3H3/t13-/m0/s1
InChIKeyMVJLNCXMAZFZJY-ZDUSSCGKSA-N
XLogP2.08
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine?
The IUPAC name of 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine (CID 153376606) is 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine.
What is the SMILES notation for 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine?
The canonical SMILES for 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine is Cc1cc(OC[C@@]2(C)CCNC2)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine?
The InChIKey is MVJLNCXMAZFZJY-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-6-12(7-11(2)15-10)16-9-13(3)4-5-14-8-13/h6-7,14H,4-5,8-9H2,1-3H3/t13-/m0/s1.
What are the key properties of 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine?
2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine has a molecular weight of 220.32 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[[(3S)-3-methylpyrrolidin-3-yl]methoxy]pyridine is sourced from PubChem (CID 153376606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).