N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide

C20H18N2O3S — CID 9153361

IUPACN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide
SMILESO=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18N2O3S/c23-20(16-8-3-1-4-9-16)22-15-19(17-10-7-13-21-14-17)26(24,25)18-11-5-2-6-12-18/h1-14,19H,15H2,(H,22,23)/t19-/m0/s1
InChIKeyNQLNTMDFHWUWFI-IBGZPJMESA-N
MW366.44 g/mol
LogP3.03
Rot. Bonds6

About N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide

N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide (PubChem CID 9153361) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide.

Molecular Properties

Compound NameN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide
PubChem CID9153361
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC NameN-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide
SMILESO=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18N2O3S/c23-20(16-8-3-1-4-9-16)22-15-19(17-10-7-13-21-14-17)26(24,25)18-11-5-2-6-12-18/h1-14,19H,15H2,(H,22,23)/t19-/m0/s1
InChIKeyNQLNTMDFHWUWFI-IBGZPJMESA-N
XLogP3.03
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]pyridine-4-carboxamide
CID 9153775
N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 21002140
N-[(2S)-2-(4-fluorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 9155547
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-3-methylbenzamide
CID 9153392
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-3-(dimethylamino)benzamide
CID 42272406
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-2-methylpropanamide
CID 9153191
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-2-methylbenzamide
CID 9153385
N-[(2S)-2-(4-propan-2-ylphenyl)sulfonyl-2-pyridin-3-ylethyl]pyridine-3-carboxamide
CID 9157955
N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)benzamide
CID 21001981
N-[(2S)-2-(benzenesulfonyl)-2-[4-(dimethylamino)phenyl]ethyl]pyridine-3-carboxamide
CID 9159404
N-[2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]pyridine-3-carboxamide
CID 110315139
4-tert-butyl-N-[2-(4-fluorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 21002100

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide?
The IUPAC name of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide (CID 9153361) is N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide.
What is the SMILES notation for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide?
The canonical SMILES for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide is O=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide?
The InChIKey is NQLNTMDFHWUWFI-IBGZPJMESA-N. The full InChI is InChI=1S/C20H18N2O3S/c23-20(16-8-3-1-4-9-16)22-15-19(17-10-7-13-21-14-17)26(24,25)18-11-5-2-6-12-18/h1-14,19H,15H2,(H,22,23)/t19-/m0/s1.
What are the key properties of N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide?
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide has a molecular weight of 366.44 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]benzamide is sourced from PubChem (CID 9153361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).