N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide

C18H27N3O5S — CID 119268085

IUPACN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide
SMILESCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C1CCCNC1
InChIInChI=1S/C18H27N3O5S/c1-2-26-17-6-5-15(27(23,24)21-8-10-25-11-9-21)12-16(17)20-18(22)14-4-3-7-19-13-14/h5-6,12,14,19H,2-4,7-11,13H2,1H3,(H,20,22)
InChIKeyXJVKCFBDFYJIOR-UHFFFAOYSA-N
MW397.50 g/mol
LogP1.04
Rot. Bonds6

About N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide

N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide (PubChem CID 119268085) has the molecular formula C18H27N3O5S and a molecular weight of 397.50 g/mol. Its IUPAC name is N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide
PubChem CID119268085
Molecular FormulaC18H27N3O5S
Molecular Weight397.50 g/mol
Exact Mass397.17
IUPAC NameN-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide
SMILESCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C1CCCNC1
InChIInChI=1S/C18H27N3O5S/c1-2-26-17-6-5-15(27(23,24)21-8-10-25-11-9-21)12-16(17)20-18(22)14-4-3-7-19-13-14/h5-6,12,14,19H,2-4,7-11,13H2,1H3,(H,20,22)
InChIKeyXJVKCFBDFYJIOR-UHFFFAOYSA-N
XLogP1.04
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.50
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119683547
N-[5-(dimethylsulfamoyl)-2-ethoxyphenyl]pyrrolidine-3-carboxamide
CID 119797775
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbutanamide
CID 46511351
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119683535
N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119270317
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-fluorophenyl)acetamide
CID 8502005
(2S)-2-amino-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)propanamide;hydrochloride
CID 119268074
2-(2,6-dichlorophenyl)-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 4881777
trans-(1R,2R)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-2-methylcyclopropane-1-carboxamide
CID 8892125
N-(2-ethoxyphenyl)piperidine-3-carboxamide
CID 18072790
N-[5-(azepan-1-ylsulfonyl)-2-ethoxyphenyl]acetamide
CID 6458874
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)-2,6-difluorobenzamide
CID 26892844

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide?
The IUPAC name of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide (CID 119268085) is N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide is CCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)C1CCCNC1.
What is the InChIKey of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide?
The InChIKey is XJVKCFBDFYJIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O5S/c1-2-26-17-6-5-15(27(23,24)21-8-10-25-11-9-21)12-16(17)20-18(22)14-4-3-7-19-13-14/h5-6,12,14,19H,2-4,7-11,13H2,1H3,(H,20,22).
What are the key properties of N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide?
N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide has a molecular weight of 397.50 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 119268085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).