[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol

C14H22N4O4S — CID 167865189

IUPAC[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol
SMILESO=S(=O)(N1CCOCC1)N1CCN(c2ccncc2CO)CC1
InChIInChI=1S/C14H22N4O4S/c19-12-13-11-15-2-1-14(13)16-3-5-17(6-4-16)23(20,21)18-7-9-22-10-8-18/h1-2,11,19H,3-10,12H2
InChIKeyNXMGNDFBZGYCPF-UHFFFAOYSA-N
MW342.42 g/mol
LogP-0.73
Rot. Bonds4

About [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol

[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol (PubChem CID 167865189) has the molecular formula C14H22N4O4S and a molecular weight of 342.42 g/mol. Its IUPAC name is [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol
PubChem CID167865189
Molecular FormulaC14H22N4O4S
Molecular Weight342.42 g/mol
Exact Mass342.14
IUPAC Name[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol
SMILESO=S(=O)(N1CCOCC1)N1CCN(c2ccncc2CO)CC1
InChIInChI=1S/C14H22N4O4S/c19-12-13-11-15-2-1-14(13)16-3-5-17(6-4-16)23(20,21)18-7-9-22-10-8-18/h1-2,11,19H,3-10,12H2
InChIKeyNXMGNDFBZGYCPF-UHFFFAOYSA-N
XLogP-0.73
TPSA86.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol (CID 167865189) is [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol is O=S(=O)(N1CCOCC1)N1CCN(c2ccncc2CO)CC1.
What is the InChIKey of [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol?
The InChIKey is NXMGNDFBZGYCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O4S/c19-12-13-11-15-2-1-14(13)16-3-5-17(6-4-16)23(20,21)18-7-9-22-10-8-18/h1-2,11,19H,3-10,12H2.
What are the key properties of [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol?
[4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol has a molecular weight of 342.42 g/mol, XLogP of -0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-morpholin-4-ylsulfonylpiperazin-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 167865189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).