N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide

C16H23N3O4S — CID 2576565

IUPACN-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide
SMILESO=C(NN1CCOCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C16H23N3O4S/c20-16(17-18-10-12-23-13-11-18)14-4-6-15(7-5-14)24(21,22)19-8-2-1-3-9-19/h4-7H,1-3,8-13H2,(H,17,20)
InChIKeyHIZKBVJHZSOTLT-UHFFFAOYSA-N
MW353.44 g/mol
LogP0.84
Rot. Bonds4

About N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide

N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide (PubChem CID 2576565) has the molecular formula C16H23N3O4S and a molecular weight of 353.44 g/mol. Its IUPAC name is N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide
PubChem CID2576565
Molecular FormulaC16H23N3O4S
Molecular Weight353.44 g/mol
Exact Mass353.14
IUPAC NameN-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide
SMILESO=C(NN1CCOCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1
InChIInChI=1S/C16H23N3O4S/c20-16(17-18-10-12-23-13-11-18)14-4-6-15(7-5-14)24(21,22)19-8-2-1-3-9-19/h4-7H,1-3,8-13H2,(H,17,20)
InChIKeyHIZKBVJHZSOTLT-UHFFFAOYSA-N
XLogP0.84
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide?
The IUPAC name of N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide (CID 2576565) is N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide.
What is the SMILES notation for N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide?
The canonical SMILES for N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide is O=C(NN1CCOCC1)c1ccc(S(=O)(=O)N2CCCCC2)cc1.
What is the InChIKey of N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide?
The InChIKey is HIZKBVJHZSOTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O4S/c20-16(17-18-10-12-23-13-11-18)14-4-6-15(7-5-14)24(21,22)19-8-2-1-3-9-19/h4-7H,1-3,8-13H2,(H,17,20).
What are the key properties of N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide?
N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide has a molecular weight of 353.44 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-morpholin-4-yl-4-piperidin-1-ylsulfonylbenzamide is sourced from PubChem (CID 2576565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).