3-chloro-2-pyrazolidin-1-ylpyridine

C8H10ClN3 — CID 130989901

IUPAC3-chloro-2-pyrazolidin-1-ylpyridine
SMILESClc1cccnc1N1CCCN1
InChIInChI=1S/C8H10ClN3/c9-7-3-1-4-10-8(7)12-6-2-5-11-12/h1,3-4,11H,2,5-6H2
InChIKeyOVMGCSWWLAWRAF-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.45
Rot. Bonds1

About 3-chloro-2-pyrazolidin-1-ylpyridine

3-chloro-2-pyrazolidin-1-ylpyridine (PubChem CID 130989901) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 3-chloro-2-pyrazolidin-1-ylpyridine.

Molecular Properties

Compound Name3-chloro-2-pyrazolidin-1-ylpyridine
PubChem CID130989901
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name3-chloro-2-pyrazolidin-1-ylpyridine
SMILESClc1cccnc1N1CCCN1
InChIInChI=1S/C8H10ClN3/c9-7-3-1-4-10-8(7)12-6-2-5-11-12/h1,3-4,11H,2,5-6H2
InChIKeyOVMGCSWWLAWRAF-UHFFFAOYSA-N
XLogP1.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-pyrazolidin-1-ylpyridine?
The IUPAC name of 3-chloro-2-pyrazolidin-1-ylpyridine (CID 130989901) is 3-chloro-2-pyrazolidin-1-ylpyridine.
What is the SMILES notation for 3-chloro-2-pyrazolidin-1-ylpyridine?
The canonical SMILES for 3-chloro-2-pyrazolidin-1-ylpyridine is Clc1cccnc1N1CCCN1.
What is the InChIKey of 3-chloro-2-pyrazolidin-1-ylpyridine?
The InChIKey is OVMGCSWWLAWRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3/c9-7-3-1-4-10-8(7)12-6-2-5-11-12/h1,3-4,11H,2,5-6H2.
What are the key properties of 3-chloro-2-pyrazolidin-1-ylpyridine?
3-chloro-2-pyrazolidin-1-ylpyridine has a molecular weight of 183.64 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-pyrazolidin-1-ylpyridine is sourced from PubChem (CID 130989901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).