2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine

C11H15ClN2O — CID 71639901

IUPAC2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine
SMILESClc1ccc(COCC2CCCN2)cn1
InChIInChI=1S/C11H15ClN2O/c12-11-4-3-9(6-14-11)7-15-8-10-2-1-5-13-10/h3-4,6,10,13H,1-2,5,7-8H2
InChIKeyGFXMYPNKKCSLRP-UHFFFAOYSA-N
MW226.71 g/mol
LogP2.00
Rot. Bonds4

About 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine

2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine (PubChem CID 71639901) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine.

Molecular Properties

Compound Name2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine
PubChem CID71639901
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC Name2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine
SMILESClc1ccc(COCC2CCCN2)cn1
InChIInChI=1S/C11H15ClN2O/c12-11-4-3-9(6-14-11)7-15-8-10-2-1-5-13-10/h3-4,6,10,13H,1-2,5,7-8H2
InChIKeyGFXMYPNKKCSLRP-UHFFFAOYSA-N
XLogP2.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-5-[[(2S)-piperidin-2-yl]methoxymethyl]pyridine
CID 97163574
(2S)-2-[(3,4-dichlorophenyl)methoxymethyl]pyrrolidine
CID 35754010
[4-(pyrrolidin-2-ylmethoxymethyl)phenyl]methanol
CID 106937811
(2S)-2-[(4-methylphenyl)methoxymethyl]pyrrolidine
CID 35753990
2-chloro-5-(pyrrolidin-2-ylmethylsulfanylmethyl)pyridine;hydrochloride
CID 71639976
4-(pyrrolidin-2-ylmethoxymethyl)pyridine;hydrochloride
CID 71637002
(2S)-2-[(3-chlorophenyl)methoxymethyl]pyrrolidine
CID 35754000
2-chloro-5-(piperidin-2-ylmethylsulfanylmethyl)pyridine;hydrochloride
CID 71639974
4-(piperidin-2-ylmethoxymethyl)benzonitrile;hydrochloride
CID 142630227
(2S)-2-[(4-methoxyphenyl)methoxymethyl]piperidine
CID 86324715
2-chloro-5-[[(3S)-piperidin-3-yl]oxymethyl]pyridine;hydrochloride
CID 71639892
2-chloro-5-[[(3R)-piperidin-3-yl]oxymethyl]pyridine;hydrochloride
CID 71639890

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine?
The IUPAC name of 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine (CID 71639901) is 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine.
What is the SMILES notation for 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine?
The canonical SMILES for 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine is Clc1ccc(COCC2CCCN2)cn1.
What is the InChIKey of 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine?
The InChIKey is GFXMYPNKKCSLRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c12-11-4-3-9(6-14-11)7-15-8-10-2-1-5-13-10/h3-4,6,10,13H,1-2,5,7-8H2.
What are the key properties of 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine?
2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine has a molecular weight of 226.71 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(pyrrolidin-2-ylmethoxymethyl)pyridine is sourced from PubChem (CID 71639901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).