N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide

C22H27N3O4S — CID 17152446

IUPACN-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCN(c2ccccc2)CC1
InChIInChI=1S/C22H27N3O4S/c26-22(18-10-12-24(13-11-18)20-4-2-1-3-5-20)23-19-6-8-21(9-7-19)30(27,28)25-14-16-29-17-15-25/h1-9,18H,10-17H2,(H,23,26)
InChIKeyCJUBQLHWVOMFCR-UHFFFAOYSA-N
MW429.54 g/mol
LogP2.56
Rot. Bonds5

About N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide

N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide (PubChem CID 17152446) has the molecular formula C22H27N3O4S and a molecular weight of 429.54 g/mol. Its IUPAC name is N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide
PubChem CID17152446
Molecular FormulaC22H27N3O4S
Molecular Weight429.54 g/mol
Exact Mass429.17
IUPAC NameN-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCN(c2ccccc2)CC1
InChIInChI=1S/C22H27N3O4S/c26-22(18-10-12-24(13-11-18)20-4-2-1-3-5-20)23-19-6-8-21(9-7-19)30(27,28)25-14-16-29-17-15-25/h1-9,18H,10-17H2,(H,23,26)
InChIKeyCJUBQLHWVOMFCR-UHFFFAOYSA-N
XLogP2.56
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.54
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-piperidin-1-ylsulfonylphenyl)oxane-4-carboxamide
CID 31962865
1-(2-methylbenzoyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-4-carboxamide
CID 25162504
N-cyclopropyl-1-(4-morpholin-4-ylsulfonylphenyl)piperidine-4-carboxamide
CID 651633
N-(4-morpholin-4-ylphenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 30885894
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide
CID 1432051
N-[4-(diethylsulfamoyl)phenyl]-1-phenylpiperidine-4-carboxamide
CID 17152471
1-(benzenesulfonyl)-N-(4-morpholin-4-ylphenyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
CID 110199911
N-(4-anilinophenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 46652612
N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]cyclopentanecarboxamide
CID 2412835
(2R)-N-(4-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 975970
(3R)-1-(4-methylphenyl)sulfonyl-N-(4-morpholin-4-ylphenyl)piperidine-3-carboxamide
CID 100525168
N-(3-morpholin-4-ylsulfonylphenyl)-1-(2-nitrophenyl)piperidine-4-carboxamide
CID 26249655

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide?
The IUPAC name of N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide (CID 17152446) is N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide?
The canonical SMILES for N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide is O=C(Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCN(c2ccccc2)CC1.
What is the InChIKey of N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide?
The InChIKey is CJUBQLHWVOMFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O4S/c26-22(18-10-12-24(13-11-18)20-4-2-1-3-5-20)23-19-6-8-21(9-7-19)30(27,28)25-14-16-29-17-15-25/h1-9,18H,10-17H2,(H,23,26).
What are the key properties of N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide?
N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide has a molecular weight of 429.54 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 17152446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).