4-(2-chlorocyclopropyl)pyridazine

C7H7ClN2 — CID 174833240

IUPAC4-(2-chlorocyclopropyl)pyridazine
SMILESClC1CC1c1ccnnc1
InChIInChI=1S/C7H7ClN2/c8-7-3-6(7)5-1-2-9-10-4-5/h1-2,4,6-7H,3H2
InChIKeyZBZWZQRIZULFFA-UHFFFAOYSA-N
MW154.60 g/mol
LogP1.57
Rot. Bonds1

About 4-(2-chlorocyclopropyl)pyridazine

4-(2-chlorocyclopropyl)pyridazine (PubChem CID 174833240) has the molecular formula C7H7ClN2 and a molecular weight of 154.60 g/mol. Its IUPAC name is 4-(2-chlorocyclopropyl)pyridazine.

Molecular Properties

Compound Name4-(2-chlorocyclopropyl)pyridazine
PubChem CID174833240
Molecular FormulaC7H7ClN2
Molecular Weight154.60 g/mol
Exact Mass154.03
IUPAC Name4-(2-chlorocyclopropyl)pyridazine
SMILESClC1CC1c1ccnnc1
InChIInChI=1S/C7H7ClN2/c8-7-3-6(7)5-1-2-9-10-4-5/h1-2,4,6-7H,3H2
InChIKeyZBZWZQRIZULFFA-UHFFFAOYSA-N
XLogP1.57
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 ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

(1R,2R,4S)-2-pyridazin-4-yl-7-azabicyclo[2.2.1]heptane
CID 10487486
5-(2-chlorocyclopropyl)pyrimidine
CID 174618230
1-(2-chlorocyclopropyl)-4-methoxybenzene
CID 53421606
4-(2H-pyran-2-yl)pyridazine
CID 138520812
4-[(2S)-piperidin-2-yl]pyridazine;hydrochloride
CID 138376376
2-pyridazin-4-ylazepane
CID 104670038
4-[(E)-2-chloroethenyl]pyridazine
CID 142782004
4-[(1S,2S)-2-methylcyclopropyl]pyridine
CID 40787591
3-[(1R,2R)-2-methylcyclopropyl]pyridine
CID 59474162
(2R)-2-pyridazin-4-ylpiperidine-1-carboxylic acid
CID 135283972
trimethyl(pyridazin-4-yl)stannane
CID 18788585
5-(2-chlorocycloheptyl)-2-methylpyridine
CID 63156025

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorocyclopropyl)pyridazine?
The IUPAC name of 4-(2-chlorocyclopropyl)pyridazine (CID 174833240) is 4-(2-chlorocyclopropyl)pyridazine.
What is the SMILES notation for 4-(2-chlorocyclopropyl)pyridazine?
The canonical SMILES for 4-(2-chlorocyclopropyl)pyridazine is ClC1CC1c1ccnnc1.
What is the InChIKey of 4-(2-chlorocyclopropyl)pyridazine?
The InChIKey is ZBZWZQRIZULFFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN2/c8-7-3-6(7)5-1-2-9-10-4-5/h1-2,4,6-7H,3H2.
What are the key properties of 4-(2-chlorocyclopropyl)pyridazine?
4-(2-chlorocyclopropyl)pyridazine has a molecular weight of 154.60 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorocyclopropyl)pyridazine is sourced from PubChem (CID 174833240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).