4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine

C14H21N3O3S — CID 5268064

IUPAC4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine
SMILESO=S(=O)(c1ccc(N2CCCCC2)nc1)N1CCOCC1
InChIInChI=1S/C14H21N3O3S/c18-21(19,17-8-10-20-11-9-17)13-4-5-14(15-12-13)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2
InChIKeyIIBSVTDDRLUKDY-UHFFFAOYSA-N
MW311.41 g/mol
LogP1.09
Rot. Bonds3

About 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine

4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine (PubChem CID 5268064) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine.

Molecular Properties

Compound Name4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine
PubChem CID5268064
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC Name4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine
SMILESO=S(=O)(c1ccc(N2CCCCC2)nc1)N1CCOCC1
InChIInChI=1S/C14H21N3O3S/c18-21(19,17-8-10-20-11-9-17)13-4-5-14(15-12-13)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2
InChIKeyIIBSVTDDRLUKDY-UHFFFAOYSA-N
XLogP1.09
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine?
The IUPAC name of 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine (CID 5268064) is 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine.
What is the SMILES notation for 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine?
The canonical SMILES for 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine is O=S(=O)(c1ccc(N2CCCCC2)nc1)N1CCOCC1.
What is the InChIKey of 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine?
The InChIKey is IIBSVTDDRLUKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c18-21(19,17-8-10-20-11-9-17)13-4-5-14(15-12-13)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2.
What are the key properties of 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine?
4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine has a molecular weight of 311.41 g/mol, XLogP of 1.09, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-piperidin-1-yl-3-pyridinyl)sulfonyl]morpholine is sourced from PubChem (CID 5268064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).