2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol

C19H24N4O4S — CID 9282198

IUPAC2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol
SMILESO=S(=O)(c1ccc(N2CCN(c3ccccc3O)CC2)nc1)N1CCOCC1
InChIInChI=1S/C19H24N4O4S/c24-18-4-2-1-3-17(18)21-7-9-22(10-8-21)19-6-5-16(15-20-19)28(25,26)23-11-13-27-14-12-23/h1-6,15,24H,7-14H2
InChIKeyXFRSUWFTNDRXKI-UHFFFAOYSA-N
MW404.49 g/mol
LogP1.13
Rot. Bonds4

About 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol

2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol (PubChem CID 9282198) has the molecular formula C19H24N4O4S and a molecular weight of 404.49 g/mol. Its IUPAC name is 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol.

Molecular Properties

Compound Name2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol
PubChem CID9282198
Molecular FormulaC19H24N4O4S
Molecular Weight404.49 g/mol
Exact Mass404.15
IUPAC Name2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol
SMILESO=S(=O)(c1ccc(N2CCN(c3ccccc3O)CC2)nc1)N1CCOCC1
InChIInChI=1S/C19H24N4O4S/c24-18-4-2-1-3-17(18)21-7-9-22(10-8-21)19-6-5-16(15-20-19)28(25,26)23-11-13-27-14-12-23/h1-6,15,24H,7-14H2
InChIKeyXFRSUWFTNDRXKI-UHFFFAOYSA-N
XLogP1.13
TPSA86.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[[6-[4-(2-methoxyphenyl)piperazin-1-yl]-3-pyridinyl]sulfonyl]morpholine
CID 9186566
1-[[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]methyl]indole-2,3-dione
CID 22109144
[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]-[(5R)-5-phenyl-4,5-dihydro-1,2-oxazol-3-yl]methanone
CID 51966024
2-methylsulfanyl-1-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]ethanone
CID 24633618
4-[[6-[4-(4-methoxyphenyl)piperazin-1-yl]-3-pyridinyl]sulfonyl]morpholine
CID 9311875
2-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]phenol
CID 4811270
(2S,6R)-2,6-dimethyl-4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)morpholine
CID 7042964
4-[[6-(4-propyl-1,4-diazepan-1-yl)-3-pyridinyl]sulfonyl]morpholine
CID 133322499
(3-methyl-1-benzothiophen-2-yl)-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]methanone
CID 24613677
2-(4-methylphenyl)-1-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]ethanone
CID 24598564
2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]-N-naphthalen-2-ylacetamide
CID 43037992
(1S)-1-(4-fluorophenyl)-2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]ethanol
CID 32605808

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol?
The IUPAC name of 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol (CID 9282198) is 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol.
What is the SMILES notation for 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol?
The canonical SMILES for 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol is O=S(=O)(c1ccc(N2CCN(c3ccccc3O)CC2)nc1)N1CCOCC1.
What is the InChIKey of 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol?
The InChIKey is XFRSUWFTNDRXKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4S/c24-18-4-2-1-3-17(18)21-7-9-22(10-8-21)19-6-5-16(15-20-19)28(25,26)23-11-13-27-14-12-23/h1-6,15,24H,7-14H2.
What are the key properties of 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol?
2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol has a molecular weight of 404.49 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-morpholin-4-ylsulfonyl-2-pyridinyl)piperazin-1-yl]phenol is sourced from PubChem (CID 9282198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).