3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine

C19H24N4O — CID 166260341

IUPAC3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine
SMILESCOc1ccccc1-c1ccc(N2CCC(N3CCCC3)C2)nn1
InChIInChI=1S/C19H24N4O/c1-24-18-7-3-2-6-16(18)17-8-9-19(21-20-17)23-13-10-15(14-23)22-11-4-5-12-22/h2-3,6-9,15H,4-5,10-14H2,1H3
InChIKeyOFCBMOZBFUBPED-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.83
Rot. Bonds4

About 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine

3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine (PubChem CID 166260341) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine
PubChem CID166260341
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine
SMILESCOc1ccccc1-c1ccc(N2CCC(N3CCCC3)C2)nn1
InChIInChI=1S/C19H24N4O/c1-24-18-7-3-2-6-16(18)17-8-9-19(21-20-17)23-13-10-15(14-23)22-11-4-5-12-22/h2-3,6-9,15H,4-5,10-14H2,1H3
InChIKeyOFCBMOZBFUBPED-UHFFFAOYSA-N
XLogP2.83
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidin-4-amine
CID 56770334
(1S)-1-[1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidin-4-yl]propan-1-ol
CID 95549741
(9aR)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 58006674
(4S,9aR)-4-cyclopropyl-8-[6-(2-methoxyphenyl)pyridazin-3-yl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine
CID 154817556
[(3S)-1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidin-3-yl]-pyridin-2-ylmethanone
CID 95552211
1-[6-(2-methoxyphenyl)pyridazin-3-yl]-N-pentylpiperidin-3-amine
CID 175425942
3,4-dihydro-1H-isoquinolin-2-yl-[1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidin-3-yl]methanone
CID 121070456
(1S,5R)-7-[6-(2-methoxyphenyl)pyridazin-3-yl]-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decane
CID 135098142
[1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 30362919
N-(3,4-dimethoxyphenyl)-1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidine-4-carboxamide
CID 30363123
N-(5-chloro-2-methoxyphenyl)-1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 121070569
1-[6-(2-methoxyphenyl)pyridazin-3-yl]-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 121070532

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine?
The IUPAC name of 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine (CID 166260341) is 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine.
What is the SMILES notation for 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine?
The canonical SMILES for 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine is COc1ccccc1-c1ccc(N2CCC(N3CCCC3)C2)nn1.
What is the InChIKey of 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine?
The InChIKey is OFCBMOZBFUBPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-24-18-7-3-2-6-16(18)17-8-9-19(21-20-17)23-13-10-15(14-23)22-11-4-5-12-22/h2-3,6-9,15H,4-5,10-14H2,1H3.
What are the key properties of 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine?
3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine has a molecular weight of 324.43 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazine is sourced from PubChem (CID 166260341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).