N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide

C16H30N4O5S — CID 22552777

IUPACN-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCCN(S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C16H30N4O5S/c21-16(17-3-5-18-6-10-24-11-7-18)15-2-1-4-20(14-15)26(22,23)19-8-12-25-13-9-19/h15H,1-14H2,(H,17,21)
InChIKeyBIMAWPJSIQIWBW-UHFFFAOYSA-N
MW390.51 g/mol
LogP-1.28
Rot. Bonds6

About N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide

N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide (PubChem CID 22552777) has the molecular formula C16H30N4O5S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
PubChem CID22552777
Molecular FormulaC16H30N4O5S
Molecular Weight390.51 g/mol
Exact Mass390.19
IUPAC NameN-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCCN(S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C16H30N4O5S/c21-16(17-3-5-18-6-10-24-11-7-18)15-2-1-4-20(14-15)26(22,23)19-8-12-25-13-9-19/h15H,1-14H2,(H,17,21)
InChIKeyBIMAWPJSIQIWBW-UHFFFAOYSA-N
XLogP-1.28
TPSA91.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 5-1.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide (CID 22552777) is N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide is O=C(NCCN1CCOCC1)C1CCCN(S(=O)(=O)N2CCOCC2)C1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
The InChIKey is BIMAWPJSIQIWBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O5S/c21-16(17-3-5-18-6-10-24-11-7-18)15-2-1-4-20(14-15)26(22,23)19-8-12-25-13-9-19/h15H,1-14H2,(H,17,21).
What are the key properties of N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide?
N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide has a molecular weight of 390.51 g/mol, XLogP of -1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 22552777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).