3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine

C10H13ClN2O — CID 79840170

IUPAC3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine
SMILESClc1cnccc1OCC1CCCN1
InChIInChI=1S/C10H13ClN2O/c11-9-6-12-5-3-10(9)14-7-8-2-1-4-13-8/h3,5-6,8,13H,1-2,4,7H2
InChIKeyYJHYJQREEDHNAR-UHFFFAOYSA-N
MW212.68 g/mol
LogP1.87
Rot. Bonds3

About 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine

3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine (PubChem CID 79840170) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine.

Molecular Properties

Compound Name3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine
PubChem CID79840170
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC Name3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine
SMILESClc1cnccc1OCC1CCCN1
InChIInChI=1S/C10H13ClN2O/c11-9-6-12-5-3-10(9)14-7-8-2-1-4-13-8/h3,5-6,8,13H,1-2,4,7H2
InChIKeyYJHYJQREEDHNAR-UHFFFAOYSA-N
XLogP1.87
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine;dihydrochloride
CID 138393569
3-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine
CID 10535320
(2R)-2-[(3-chloro-2-fluorophenoxy)methyl]pyrrolidine
CID 102820264
3-nitro-4-(piperidin-2-ylmethoxy)pyridine
CID 62349163
3-chloro-N-(pyrrolidin-2-ylmethyl)pyridin-4-amine
CID 79841307
3-chloro-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
CID 94406451
(2S)-2-[(2-chloro-4-methoxyphenoxy)methyl]pyrrolidine
CID 28750046
3-chloro-4-methoxy-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
CID 156847857
2-[(3,4-dichlorophenoxy)methyl]pyrrolidine
CID 22456719
(2R)-2-[(3,4-dichlorophenoxy)methyl]pyrrolidine
CID 102820118
5-chloro-4-(piperidin-2-ylmethoxy)pyrimidine
CID 105370446
(2R)-2-[(2,6-dichlorophenoxy)methyl]pyrrolidine
CID 102820117

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine?
The IUPAC name of 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine (CID 79840170) is 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine.
What is the SMILES notation for 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine?
The canonical SMILES for 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine is Clc1cnccc1OCC1CCCN1.
What is the InChIKey of 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine?
The InChIKey is YJHYJQREEDHNAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c11-9-6-12-5-3-10(9)14-7-8-2-1-4-13-8/h3,5-6,8,13H,1-2,4,7H2.
What are the key properties of 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine?
3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine has a molecular weight of 212.68 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-(pyrrolidin-2-ylmethoxy)pyridine is sourced from PubChem (CID 79840170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).