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

C11H15ClN2O2 — CID 156847857

IUPAC3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
SMILESCOc1ccnc(OC[C@H]2CCCN2)c1Cl
InChIInChI=1S/C11H15ClN2O2/c1-15-9-4-6-14-11(10(9)12)16-7-8-3-2-5-13-8/h4,6,8,13H,2-3,5,7H2,1H3/t8-/m1/s1
InChIKeyPYLWWNSSPGUAFU-MRVPVSSYSA-N
MW242.71 g/mol
LogP1.87
Rot. Bonds4

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

3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine (PubChem CID 156847857) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine.

Molecular Properties

Compound Name3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
PubChem CID156847857
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC Name3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
SMILESCOc1ccnc(OC[C@H]2CCCN2)c1Cl
InChIInChI=1S/C11H15ClN2O2/c1-15-9-4-6-14-11(10(9)12)16-7-8-3-2-5-13-8/h4,6,8,13H,2-3,5,7H2,1H3/t8-/m1/s1
InChIKeyPYLWWNSSPGUAFU-MRVPVSSYSA-N
XLogP1.87
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-3-(pyrrolidin-2-ylmethoxy)pyridine
CID 122208651
3-chloro-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
CID 94406451
8-chloro-1-(pyrrolidin-2-ylmethoxy)isoquinoline
CID 82569796
3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine
CID 79840170
6-methoxy-1-(piperidin-2-ylmethoxy)isoquinoline
CID 106542068
2-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
CID 117096153
(2S)-2-[(2-chloro-4-methoxyphenoxy)methyl]pyrrolidine
CID 28750046
(2R)-2-[(5-fluoro-2-methoxyphenoxy)methyl]pyrrolidine
CID 67315733
methyl 2-(pyrrolidin-2-ylmethoxy)pyridine-3-carboxylate
CID 62347787
2-methoxy-3-[[(2R)-pyrrolidin-2-yl]methoxymethyl]pyrazine
CID 97164864
N-methyl-1-(pyrrolidin-2-ylmethoxy)isoquinolin-5-amine
CID 82572627
2-chloro-3-methoxy-6-(pyrrolidin-2-ylmethyl)phenol
CID 84801195

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine?
The IUPAC name of 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine (CID 156847857) is 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine.
What is the SMILES notation for 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine?
The canonical SMILES for 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine is COc1ccnc(OC[C@H]2CCCN2)c1Cl.
What is the InChIKey of 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine?
The InChIKey is PYLWWNSSPGUAFU-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-15-9-4-6-14-11(10(9)12)16-7-8-3-2-5-13-8/h4,6,8,13H,2-3,5,7H2,1H3/t8-/m1/s1.
What are the key properties of 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine?
3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine has a molecular weight of 242.71 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine is sourced from PubChem (CID 156847857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).