3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine

C15H22ClN3 — CID 63271560

IUPAC3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine
SMILESCc1c(Cl)nnc(N2CCCC2C2CCCC2)c1C
InChIInChI=1S/C15H22ClN3/c1-10-11(2)15(18-17-14(10)16)19-9-5-8-13(19)12-6-3-4-7-12/h12-13H,3-9H2,1-2H3
InChIKeyMHUFBRVUYLXLBM-UHFFFAOYSA-N
MW279.81 g/mol
LogP3.91
Rot. Bonds2

About 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine

3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine (PubChem CID 63271560) has the molecular formula C15H22ClN3 and a molecular weight of 279.81 g/mol. Its IUPAC name is 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine.

Molecular Properties

Compound Name3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine
PubChem CID63271560
Molecular FormulaC15H22ClN3
Molecular Weight279.81 g/mol
Exact Mass279.15
IUPAC Name3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine
SMILESCc1c(Cl)nnc(N2CCCC2C2CCCC2)c1C
InChIInChI=1S/C15H22ClN3/c1-10-11(2)15(18-17-14(10)16)19-9-5-8-13(19)12-6-3-4-7-12/h12-13H,3-9H2,1-2H3
InChIKeyMHUFBRVUYLXLBM-UHFFFAOYSA-N
XLogP3.91
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.81
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine?
The IUPAC name of 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine (CID 63271560) is 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine.
What is the SMILES notation for 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine?
The canonical SMILES for 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine is Cc1c(Cl)nnc(N2CCCC2C2CCCC2)c1C.
What is the InChIKey of 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine?
The InChIKey is MHUFBRVUYLXLBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3/c1-10-11(2)15(18-17-14(10)16)19-9-5-8-13(19)12-6-3-4-7-12/h12-13H,3-9H2,1-2H3.
What are the key properties of 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine?
3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine has a molecular weight of 279.81 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(2-cyclopentylpyrrolidin-1-yl)-4,5-dimethylpyridazine is sourced from PubChem (CID 63271560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).