N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide

C8H11ClN2O2S — CID 100762146

IUPACN-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide
SMILESC[C@H](NS(C)(=O)=O)c1ccc(Cl)cn1
InChIInChI=1S/C8H11ClN2O2S/c1-6(11-14(2,12)13)8-4-3-7(9)5-10-8/h3-6,11H,1-2H3/t6-/m0/s1
InChIKeyCEPPHOSCKGPQKB-LURJTMIESA-N
MW234.71 g/mol
LogP1.35
Rot. Bonds3

About N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide

N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide (PubChem CID 100762146) has the molecular formula C8H11ClN2O2S and a molecular weight of 234.71 g/mol. Its IUPAC name is N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide
PubChem CID100762146
Molecular FormulaC8H11ClN2O2S
Molecular Weight234.71 g/mol
Exact Mass234.02
IUPAC NameN-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide
SMILESC[C@H](NS(C)(=O)=O)c1ccc(Cl)cn1
InChIInChI=1S/C8H11ClN2O2S/c1-6(11-14(2,12)13)8-4-3-7(9)5-10-8/h3-6,11H,1-2H3/t6-/m0/s1
InChIKeyCEPPHOSCKGPQKB-LURJTMIESA-N
XLogP1.35
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.71
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-pyridin-2-ylethyl)methanesulfonamide
CID 60681407
N-[1-(5-chloro-2-pyridinyl)ethyl]but-2-yn-1-amine
CID 131086161
(1R)-1-(5-chloro-2-pyridinyl)ethanol
CID 75356463
2-(1-bromoethyl)-5-chloropyridine
CID 58279845
(1R)-1-(5-chloro-2-pyridinyl)ethanamine;dihydrochloride
CID 75524979
N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]-5-nitropyrimidin-2-amine
CID 99802727
(1R,2S)-1-(5-chloro-2-pyridinyl)-1-methoxypropane-2-sulfonamide;(1S,2R)-1-(5-chloro-2-pyridinyl)-1-methoxypropane-2-sulfonamide
CID 161413357
5-chloro-N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]pyridine-3-carboxamide
CID 155965739
1-(5-chloro-2-pyridinyl)-1-propan-2-yloxypropane-2-sulfonamide
CID 126581769
N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]-2,6-dimethylpyrimidin-4-amine
CID 154736081
2,2-dichloro-N-[3-fluoro-1-hydroxy-1-[4-[6-[1-(methanesulfonamido)ethyl]-3-pyridinyl]phenyl]propan-2-yl]acetamide
CID 123653877
1-(5-chloro-2-pyridinyl)-N-propan-2-ylmethanesulfonamide
CID 126637158

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide?
The IUPAC name of N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide (CID 100762146) is N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide?
The canonical SMILES for N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide is C[C@H](NS(C)(=O)=O)c1ccc(Cl)cn1.
What is the InChIKey of N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide?
The InChIKey is CEPPHOSCKGPQKB-LURJTMIESA-N. The full InChI is InChI=1S/C8H11ClN2O2S/c1-6(11-14(2,12)13)8-4-3-7(9)5-10-8/h3-6,11H,1-2H3/t6-/m0/s1.
What are the key properties of N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide?
N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide has a molecular weight of 234.71 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(5-chloro-2-pyridinyl)ethyl]methanesulfonamide is sourced from PubChem (CID 100762146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).