5-chloro-3-cyclopropylpyridazine

C7H7ClN2 — CID 117107176

IUPAC5-chloro-3-cyclopropylpyridazine
SMILESClc1cnnc(C2CC2)c1
InChIInChI=1S/C7H7ClN2/c8-6-3-7(5-1-2-5)10-9-4-6/h3-5H,1-2H2
InChIKeyHGQWMTWRKJGBLR-UHFFFAOYSA-N
MW154.60 g/mol
LogP2.01
Rot. Bonds1

About 5-chloro-3-cyclopropylpyridazine

5-chloro-3-cyclopropylpyridazine (PubChem CID 117107176) has the molecular formula C7H7ClN2 and a molecular weight of 154.60 g/mol. Its IUPAC name is 5-chloro-3-cyclopropylpyridazine.

Molecular Properties

Compound Name5-chloro-3-cyclopropylpyridazine
PubChem CID117107176
Molecular FormulaC7H7ClN2
Molecular Weight154.60 g/mol
Exact Mass154.03
IUPAC Name5-chloro-3-cyclopropylpyridazine
SMILESClc1cnnc(C2CC2)c1
InChIInChI=1S/C7H7ClN2/c8-6-3-7(5-1-2-5)10-9-4-6/h3-5H,1-2H2
InChIKeyHGQWMTWRKJGBLR-UHFFFAOYSA-N
XLogP2.01
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-cyclopropylpyridazine?
The IUPAC name of 5-chloro-3-cyclopropylpyridazine (CID 117107176) is 5-chloro-3-cyclopropylpyridazine.
What is the SMILES notation for 5-chloro-3-cyclopropylpyridazine?
The canonical SMILES for 5-chloro-3-cyclopropylpyridazine is Clc1cnnc(C2CC2)c1.
What is the InChIKey of 5-chloro-3-cyclopropylpyridazine?
The InChIKey is HGQWMTWRKJGBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2/c8-6-3-7(5-1-2-5)10-9-4-6/h3-5H,1-2H2.
What are the key properties of 5-chloro-3-cyclopropylpyridazine?
5-chloro-3-cyclopropylpyridazine has a molecular weight of 154.60 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-cyclopropylpyridazine is sourced from PubChem (CID 117107176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).