N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide

C14H15ClN2O4S2 — CID 9156145

IUPACN-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
SMILESCS(=O)(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2O4S2/c1-22(18,19)17-10-14(11-3-2-8-16-9-11)23(20,21)13-6-4-12(15)5-7-13/h2-9,14,17H,10H2,1H3/t14-/m0/s1
InChIKeyOZRLLYNKLSBQQD-AWEZNQCLSA-N
MW374.87 g/mol
LogP1.80
Rot. Bonds6

About N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide

N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide (PubChem CID 9156145) has the molecular formula C14H15ClN2O4S2 and a molecular weight of 374.87 g/mol. Its IUPAC name is N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
PubChem CID9156145
Molecular FormulaC14H15ClN2O4S2
Molecular Weight374.87 g/mol
Exact Mass374.02
IUPAC NameN-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
SMILESCS(=O)(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2O4S2/c1-22(18,19)17-10-14(11-3-2-8-16-9-11)23(20,21)13-6-4-12(15)5-7-13/h2-9,14,17H,10H2,1H3/t14-/m0/s1
InChIKeyOZRLLYNKLSBQQD-AWEZNQCLSA-N
XLogP1.80
TPSA93.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.87
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-(4-propan-2-ylphenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
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N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]-2-phenylethanesulfonamide
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1-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
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N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]-3-phenylpropane-1-sulfonamide
CID 42272396
N-[2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 21002140
1-(4-chlorophenyl)-N-[2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide
CID 20996539
N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]ethanesulfonamide
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N'-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]-N-prop-2-enyloxamide
CID 9156533
N-[(2R)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-4-fluoro-3-methylbenzenesulfonamide
CID 40903729
4-chloro-N-[2-(4-ethoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]benzamide
CID 21007712
2-(4-chlorophenoxy)-N-[(2R)-2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide?
The IUPAC name of N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide (CID 9156145) is N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide.
What is the SMILES notation for N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide?
The canonical SMILES for N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide is CS(=O)(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide?
The InChIKey is OZRLLYNKLSBQQD-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H15ClN2O4S2/c1-22(18,19)17-10-14(11-3-2-8-16-9-11)23(20,21)13-6-4-12(15)5-7-13/h2-9,14,17H,10H2,1H3/t14-/m0/s1.
What are the key properties of N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide?
N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide has a molecular weight of 374.87 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-chlorophenyl)sulfonyl-2-pyridin-3-ylethyl]methanesulfonamide is sourced from PubChem (CID 9156145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).