3-chloro-6-pyrrolidin-1-ylpyridazine

C8H10ClN3 — CID 7020363

IUPAC3-chloro-6-pyrrolidin-1-ylpyridazine
SMILESClc1ccc(N2CCCC2)nn1
InChIInChI=1S/C8H10ClN3/c9-7-3-4-8(11-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2
InChIKeyNYOJAXJOBBCOEF-UHFFFAOYSA-N
MW183.64 g/mol
LogP1.73
Rot. Bonds1

About 3-chloro-6-pyrrolidin-1-ylpyridazine

3-chloro-6-pyrrolidin-1-ylpyridazine (PubChem CID 7020363) has the molecular formula C8H10ClN3 and a molecular weight of 183.64 g/mol. Its IUPAC name is 3-chloro-6-pyrrolidin-1-ylpyridazine.

Molecular Properties

Compound Name3-chloro-6-pyrrolidin-1-ylpyridazine
PubChem CID7020363
Molecular FormulaC8H10ClN3
Molecular Weight183.64 g/mol
Exact Mass183.06
IUPAC Name3-chloro-6-pyrrolidin-1-ylpyridazine
SMILESClc1ccc(N2CCCC2)nn1
InChIInChI=1S/C8H10ClN3/c9-7-3-4-8(11-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2
InChIKeyNYOJAXJOBBCOEF-UHFFFAOYSA-N
XLogP1.73
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-pyrrolidin-1-ylpyridazine?
The IUPAC name of 3-chloro-6-pyrrolidin-1-ylpyridazine (CID 7020363) is 3-chloro-6-pyrrolidin-1-ylpyridazine.
What is the SMILES notation for 3-chloro-6-pyrrolidin-1-ylpyridazine?
The canonical SMILES for 3-chloro-6-pyrrolidin-1-ylpyridazine is Clc1ccc(N2CCCC2)nn1.
What is the InChIKey of 3-chloro-6-pyrrolidin-1-ylpyridazine?
The InChIKey is NYOJAXJOBBCOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3/c9-7-3-4-8(11-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2.
What are the key properties of 3-chloro-6-pyrrolidin-1-ylpyridazine?
3-chloro-6-pyrrolidin-1-ylpyridazine has a molecular weight of 183.64 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-pyrrolidin-1-ylpyridazine is sourced from PubChem (CID 7020363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).