3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine

C10H13Cl2N3O — CID 114796380

IUPAC3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine
SMILESClc1cc(OCCC2CCNC2)c(Cl)nn1
InChIInChI=1S/C10H13Cl2N3O/c11-9-5-8(10(12)15-14-9)16-4-2-7-1-3-13-6-7/h5,7,13H,1-4,6H2
InChIKeyCZOAJMWUWCKNRL-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.16
Rot. Bonds4

About 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine

3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine (PubChem CID 114796380) has the molecular formula C10H13Cl2N3O and a molecular weight of 262.14 g/mol. Its IUPAC name is 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine.

Molecular Properties

Compound Name3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine
PubChem CID114796380
Molecular FormulaC10H13Cl2N3O
Molecular Weight262.14 g/mol
Exact Mass261.04
IUPAC Name3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine
SMILESClc1cc(OCCC2CCNC2)c(Cl)nn1
InChIInChI=1S/C10H13Cl2N3O/c11-9-5-8(10(12)15-14-9)16-4-2-7-1-3-13-6-7/h5,7,13H,1-4,6H2
InChIKeyCZOAJMWUWCKNRL-UHFFFAOYSA-N
XLogP2.16
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-2-(2-pyrrolidin-3-ylethoxy)benzamide
CID 114796482
3-chloro-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796420
2-[(3,6-dichloropyridazin-4-yl)oxymethyl]morpholine
CID 114468893
4-chloro-2-(2-pyrrolidin-3-ylethoxy)benzonitrile
CID 114796365
4-[2-(2,4,5-trichlorophenoxy)ethyl]piperidine
CID 56830089
5-chloro-4-(2-pyrrolidin-3-ylethoxy)-1H-pyrimidin-6-one
CID 114796574
3-chloro-2-(2-pyrrolidin-3-ylethoxy)-5-(trifluoromethyl)pyridine
CID 114796299
6-(2-pyrrolidin-3-ylethoxy)pyridine-3-carboxamide
CID 114796308
3-propoxy-2-(2-pyrrolidin-3-ylethoxy)pyridine
CID 114796587
3-[2-(2-fluorophenoxy)ethyl]pyrrolidine;hydrochloride
CID 146064557
(3R)-3-[2-(2,4-dichlorophenoxy)ethyl]piperidine
CID 86320969
2-pyrrolidin-3-ylethyl N-(3,4-dichlorophenyl)carbamate
CID 114796625

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine?
The IUPAC name of 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine (CID 114796380) is 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine.
What is the SMILES notation for 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine?
The canonical SMILES for 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine is Clc1cc(OCCC2CCNC2)c(Cl)nn1.
What is the InChIKey of 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine?
The InChIKey is CZOAJMWUWCKNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3O/c11-9-5-8(10(12)15-14-9)16-4-2-7-1-3-13-6-7/h5,7,13H,1-4,6H2.
What are the key properties of 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine?
3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine has a molecular weight of 262.14 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-4-(2-pyrrolidin-3-ylethoxy)pyridazine is sourced from PubChem (CID 114796380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).