4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine

C11H16N2O2 — CID 122185348

IUPAC4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
SMILESCOc1ccncc1OC[C@@H]1CCCN1
InChIInChI=1S/C11H16N2O2/c1-14-10-4-6-12-7-11(10)15-8-9-3-2-5-13-9/h4,6-7,9,13H,2-3,5,8H2,1H3/t9-/m0/s1
InChIKeyLNSWECRSSXELIU-VIFPVBQESA-N
MW208.26 g/mol
LogP1.22
Rot. Bonds4

About 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine

4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine (PubChem CID 122185348) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine.

Molecular Properties

Compound Name4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
PubChem CID122185348
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
SMILESCOc1ccncc1OC[C@@H]1CCCN1
InChIInChI=1S/C11H16N2O2/c1-14-10-4-6-12-7-11(10)15-8-9-3-2-5-13-9/h4,6-7,9,13H,2-3,5,8H2,1H3/t9-/m0/s1
InChIKeyLNSWECRSSXELIU-VIFPVBQESA-N
XLogP1.22
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The IUPAC name of 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine (CID 122185348) is 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine.
What is the SMILES notation for 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The canonical SMILES for 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine is COc1ccncc1OC[C@@H]1CCCN1.
What is the InChIKey of 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
The InChIKey is LNSWECRSSXELIU-VIFPVBQESA-N. The full InChI is InChI=1S/C11H16N2O2/c1-14-10-4-6-12-7-11(10)15-8-9-3-2-5-13-9/h4,6-7,9,13H,2-3,5,8H2,1H3/t9-/m0/s1.
What are the key properties of 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine?
4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine has a molecular weight of 208.26 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine is sourced from PubChem (CID 122185348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).