4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine

C8H8Cl2N2 — CID 130673471

IUPAC4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine
SMILESClc1cc([C@H]2CCN2)c(Cl)cn1
InChIInChI=1S/C8H8Cl2N2/c9-6-4-12-8(10)3-5(6)7-1-2-11-7/h3-4,7,11H,1-2H2/t7-/m1/s1
InChIKeyRMRHAFKJUYBWCO-SSDOTTSWSA-N
MW203.07 g/mol
LogP2.42
Rot. Bonds1

About 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine

4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine (PubChem CID 130673471) has the molecular formula C8H8Cl2N2 and a molecular weight of 203.07 g/mol. Its IUPAC name is 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine.

Molecular Properties

Compound Name4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine
PubChem CID130673471
Molecular FormulaC8H8Cl2N2
Molecular Weight203.07 g/mol
Exact Mass202.01
IUPAC Name4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine
SMILESClc1cc([C@H]2CCN2)c(Cl)cn1
InChIInChI=1S/C8H8Cl2N2/c9-6-4-12-8(10)3-5(6)7-1-2-11-7/h3-4,7,11H,1-2H2/t7-/m1/s1
InChIKeyRMRHAFKJUYBWCO-SSDOTTSWSA-N
XLogP2.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.07
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[(2S)-azetidin-2-yl]-3-chloropyridine;hydrochloride
CID 171196638
2,4-dichloro-5-[(2R)-piperidin-2-yl]pyridine
CID 130788142
2,5-dichloro-4-piperidin-3-ylpyridine
CID 84694263
3-[(2R)-azetidin-2-yl]-2-bromo-5-chloropyridine
CID 130663764
2-chloro-5-[(2R)-piperidin-2-yl]pyridin-4-amine
CID 130783796
4-(azetidin-2-yl)-2-chloropyridine
CID 55294385
4-[(2S)-azetidin-2-yl]-2,3,5-trichloropyridine
CID 130975037
2-chloro-4-methoxy-5-[(2R)-pyrrolidin-2-yl]pyridine
CID 131072200
3-(azetidin-2-yl)-5-chloro-2-methoxypyridine
CID 55272549
3-(2,5-dichloro-4-pyridinyl)cyclopentan-1-one
CID 130045264
4-[(2R)-azetidin-2-yl]-3-chlorophenol
CID 130700334
(2R)-2-(2-chloro-4-methylphenyl)azetidine
CID 130738844

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine?
The IUPAC name of 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine (CID 130673471) is 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine.
What is the SMILES notation for 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine?
The canonical SMILES for 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine is Clc1cc([C@H]2CCN2)c(Cl)cn1.
What is the InChIKey of 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine?
The InChIKey is RMRHAFKJUYBWCO-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H8Cl2N2/c9-6-4-12-8(10)3-5(6)7-1-2-11-7/h3-4,7,11H,1-2H2/t7-/m1/s1.
What are the key properties of 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine?
4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine has a molecular weight of 203.07 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-azetidin-2-yl]-2,5-dichloropyridine is sourced from PubChem (CID 130673471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).