(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide

C16H23N3O4S — CID 97343329

IUPAC(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C16H23N3O4S/c20-16(17-14-5-2-1-3-6-14)18-8-4-7-15(13-18)24(21,22)19-9-11-23-12-10-19/h1-3,5-6,15H,4,7-13H2,(H,17,20)/t15-/m0/s1
InChIKeyRLAFFORNGJZNTL-HNNXBMFYSA-N
MW353.44 g/mol
LogP1.34
Rot. Bonds3

About (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide

(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide (PubChem CID 97343329) has the molecular formula C16H23N3O4S and a molecular weight of 353.44 g/mol. Its IUPAC name is (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide
PubChem CID97343329
Molecular FormulaC16H23N3O4S
Molecular Weight353.44 g/mol
Exact Mass353.14
IUPAC Name(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C16H23N3O4S/c20-16(17-14-5-2-1-3-6-14)18-8-4-7-15(13-18)24(21,22)19-9-11-23-12-10-19/h1-3,5-6,15H,4,7-13H2,(H,17,20)/t15-/m0/s1
InChIKeyRLAFFORNGJZNTL-HNNXBMFYSA-N
XLogP1.34
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-morpholin-4-ylsulfonylpiperidin-1-yl)-phenylmethanone
CID 75473929
(3R)-N-[2-(dimethylamino)pyrimidin-5-yl]-3-morpholin-4-ylsulfonylpiperidine-1-carboxamide
CID 97344454
(3R)-N-(1-tert-butylpyrazol-4-yl)-3-morpholin-4-ylsulfonylpiperidine-1-carboxamide
CID 97344342
(2-methylphenyl)-[(3S)-3-morpholin-4-ylsulfonylpiperidin-1-yl]methanone
CID 97343511
phenyl-(3-pyrrolidin-1-ylsulfonylpiperidin-1-yl)methanone
CID 75474346
(3R)-N-phenyl-3-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 8868811
1-(3-morpholin-4-ylsulfonylpiperidin-1-yl)-2-thiophen-2-ylpropan-1-one
CID 127778958
(3R)-3-N-[(1-morpholin-4-ylcyclohexyl)methyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 31288160
3-(cyclohexylamino)-N-phenylpiperidine-1-carboxamide
CID 83999198
4H-1,3-benzodioxin-6-yl-(3-morpholin-4-ylsulfonylpiperidin-1-yl)methanone
CID 75473926
[(3S)-3-morpholin-4-ylsulfonylpiperidin-1-yl]-[6-(trifluoromethyl)-3-pyridinyl]methanone
CID 97343487
(3R)-N-(3-cyclopentylsulfonylphenyl)-3-(1,3-dioxolan-2-yl)piperidine-1-carboxamide
CID 95268330

Frequently Asked Questions

What is the IUPAC name of (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide?
The IUPAC name of (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide (CID 97343329) is (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide is O=C(Nc1ccccc1)N1CCC[C@H](S(=O)(=O)N2CCOCC2)C1.
What is the InChIKey of (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide?
The InChIKey is RLAFFORNGJZNTL-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H23N3O4S/c20-16(17-14-5-2-1-3-6-14)18-8-4-7-15(13-18)24(21,22)19-9-11-23-12-10-19/h1-3,5-6,15H,4,7-13H2,(H,17,20)/t15-/m0/s1.
What are the key properties of (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide?
(3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide has a molecular weight of 353.44 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-morpholin-4-ylsulfonyl-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 97343329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).