4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide

C19H24N4O3S — CID 113038800

IUPAC4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCCC2)nn1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H24N4O3S/c24-27(25,17-9-7-16(8-10-17)26-15-5-1-2-6-15)22-18-11-12-19(21-20-18)23-13-3-4-14-23/h7-12,15H,1-6,13-14H2,(H,20,22)
InChIKeyFASPHNAYOIICLH-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.20
Rot. Bonds6

About 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide

4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide (PubChem CID 113038800) has the molecular formula C19H24N4O3S and a molecular weight of 388.49 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
PubChem CID113038800
Molecular FormulaC19H24N4O3S
Molecular Weight388.49 g/mol
Exact Mass388.16
IUPAC Name4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCCC2)nn1)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H24N4O3S/c24-27(25,17-9-7-16(8-10-17)26-15-5-1-2-6-15)22-18-11-12-19(21-20-18)23-13-3-4-14-23/h7-12,15H,1-6,13-14H2,(H,20,22)
InChIKeyFASPHNAYOIICLH-UHFFFAOYSA-N
XLogP3.20
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-cyclopentyloxy-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024414
4-ethoxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113038808
N-[6-(azepan-1-yl)pyridazin-3-yl]-3,4-dimethoxybenzenesulfonamide
CID 113045402
4-chloro-N-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113039262
N-[6-(azepan-1-yl)pyridazin-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 113045406
2,5-dimethoxy-N-(6-piperidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113039038
N-(6-morpholin-4-ylpyridazin-3-yl)benzenesulfonamide
CID 2999131
N-[6-(cycloheptylamino)pyridazin-3-yl]-4-methoxybenzenesulfonamide
CID 16941956
2-chloro-N-(6-piperidin-1-ylpyridazin-3-yl)benzenesulfonamide
CID 113039063
3-(dimethylsulfamoylamino)-6-piperidin-1-ylpyridazine
CID 113039016
N-[6-(4-pyridin-2-ylpiperazin-1-yl)pyridazin-3-yl]benzenesulfonamide
CID 113043896
N-(6-pyrrolidin-1-ylpyridazin-3-yl)propane-1-sulfonamide
CID 113038761

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide?
The IUPAC name of 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide (CID 113038800) is 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide?
The canonical SMILES for 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCCC2)nn1)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide?
The InChIKey is FASPHNAYOIICLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3S/c24-27(25,17-9-7-16(8-10-17)26-15-5-1-2-6-15)22-18-11-12-19(21-20-18)23-13-3-4-14-23/h7-12,15H,1-6,13-14H2,(H,20,22).
What are the key properties of 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide?
4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide has a molecular weight of 388.49 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-(6-pyrrolidin-1-ylpyridazin-3-yl)benzenesulfonamide is sourced from PubChem (CID 113038800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).