1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide

C22H34N4O6S — CID 73258945

IUPAC1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
SMILESCOc1ccc(S(=O)(=O)N2CCC(C(=O)NC(C)C(=O)NCCN3CCOCC3)CC2)cc1
InChIInChI=1S/C22H34N4O6S/c1-17(21(27)23-9-12-25-13-15-32-16-14-25)24-22(28)18-7-10-26(11-8-18)33(29,30)20-5-3-19(31-2)4-6-20/h3-6,17-18H,7-16H2,1-2H3,(H,23,27)(H,24,28)
InChIKeyMGKHZTRDIDMGOD-UHFFFAOYSA-N
MW482.60 g/mol
LogP0.05
Rot. Bonds9

About 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide

1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide (PubChem CID 73258945) has the molecular formula C22H34N4O6S and a molecular weight of 482.60 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
PubChem CID73258945
Molecular FormulaC22H34N4O6S
Molecular Weight482.60 g/mol
Exact Mass482.22
IUPAC Name1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
SMILESCOc1ccc(S(=O)(=O)N2CCC(C(=O)NC(C)C(=O)NCCN3CCOCC3)CC2)cc1
InChIInChI=1S/C22H34N4O6S/c1-17(21(27)23-9-12-25-13-15-32-16-14-25)24-22(28)18-7-10-26(11-8-18)33(29,30)20-5-3-19(31-2)4-6-20/h3-6,17-18H,7-16H2,1-2H3,(H,23,27)(H,24,28)
InChIKeyMGKHZTRDIDMGOD-UHFFFAOYSA-N
XLogP0.05
TPSA117.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.60
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide with MolForge

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Related Compounds

1-(4-methoxyphenyl)sulfonyl-N-[(2R)-1-methoxypropan-2-yl]piperidine-4-carboxamide
CID 7248361
1-(4-methoxyphenyl)sulfonyl-N-[1-(naphthalen-1-ylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide
CID 73401614
4-[[(4-fluorophenyl)sulfonylamino]methyl]-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]cyclohexane-1-carboxamide
CID 45370457
N-[(2S)-1-(4-methoxyphenoxy)propan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 100654629
N-[1-(4-methoxyphenoxy)propan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 133167682
1-naphthalen-2-ylsulfonyl-N-[1-oxo-1-(propylamino)propan-2-yl]piperidine-4-carboxamide
CID 46520815
N-butyl-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 2188546
1-(4-methoxyphenyl)sulfonyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-4-carboxamide
CID 133167697
1-(4-methoxyphenyl)sulfonyl-N-[3-(3-methylpiperidin-1-yl)propyl]piperidine-4-carboxamide
CID 133167714
(3R)-N-[(2R)-1-(benzylamino)-1-oxopropan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 97038069
N-(2,2-dimethylpropyl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 100799217
N-[3-(4-methoxyphenyl)propyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 100656350

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide (CID 73258945) is 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide is COc1ccc(S(=O)(=O)N2CCC(C(=O)NC(C)C(=O)NCCN3CCOCC3)CC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide?
The InChIKey is MGKHZTRDIDMGOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N4O6S/c1-17(21(27)23-9-12-25-13-15-32-16-14-25)24-22(28)18-7-10-26(11-8-18)33(29,30)20-5-3-19(31-2)4-6-20/h3-6,17-18H,7-16H2,1-2H3,(H,23,27)(H,24,28).
What are the key properties of 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide?
1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide has a molecular weight of 482.60 g/mol, XLogP of 0.05, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)sulfonyl-N-[1-(2-morpholin-4-ylethylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide is sourced from PubChem (CID 73258945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).