3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine

C13H19ClN4 — CID 114478285

IUPAC3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine
SMILESClc1cc(N2CCC(N3CCCCC3)C2)cnn1
InChIInChI=1S/C13H19ClN4/c14-13-8-12(9-15-16-13)18-7-4-11(10-18)17-5-2-1-3-6-17/h8-9,11H,1-7,10H2
InChIKeyDYZUWSDHGOAYKW-UHFFFAOYSA-N
MW266.78 g/mol
LogP2.19
Rot. Bonds2

About 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine

3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine (PubChem CID 114478285) has the molecular formula C13H19ClN4 and a molecular weight of 266.78 g/mol. Its IUPAC name is 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine.

Molecular Properties

Compound Name3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine
PubChem CID114478285
Molecular FormulaC13H19ClN4
Molecular Weight266.78 g/mol
Exact Mass266.13
IUPAC Name3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine
SMILESClc1cc(N2CCC(N3CCCCC3)C2)cnn1
InChIInChI=1S/C13H19ClN4/c14-13-8-12(9-15-16-13)18-7-4-11(10-18)17-5-2-1-3-6-17/h8-9,11H,1-7,10H2
InChIKeyDYZUWSDHGOAYKW-UHFFFAOYSA-N
XLogP2.19
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.78
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6-chloropyridazin-4-yl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 114478326
5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
CID 113424017
3-chloro-5-(3-methylpyrrolidin-1-yl)pyridazine
CID 114478162
3-(3-piperidin-1-ylpyrrolidin-1-yl)aniline
CID 63168101
(1R)-1-[4-(3-piperidin-1-ylpyrrolidin-1-yl)phenyl]ethanamine
CID 78936816
N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
CID 104534506
5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine-2-carbothioamide
CID 115488588
5-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-4-amine
CID 83265929
5-chloro-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyrimidin-2-amine
CID 80828314
3-chloro-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)aniline
CID 63168533
2-(3,4-dichlorophenyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929688
3-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)aniline
CID 112647756

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine?
The IUPAC name of 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine (CID 114478285) is 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine.
What is the SMILES notation for 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine?
The canonical SMILES for 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine is Clc1cc(N2CCC(N3CCCCC3)C2)cnn1.
What is the InChIKey of 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine?
The InChIKey is DYZUWSDHGOAYKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN4/c14-13-8-12(9-15-16-13)18-7-4-11(10-18)17-5-2-1-3-6-17/h8-9,11H,1-7,10H2.
What are the key properties of 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine?
3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine has a molecular weight of 266.78 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine is sourced from PubChem (CID 114478285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).