N-ethylmethanesulfonamide;hydrochloride

C3H10ClNO2S — CID 87431036

IUPACN-ethylmethanesulfonamide;hydrochloride
SMILESCCNS(C)(=O)=O.Cl
InChIInChI=1S/C3H9NO2S.ClH/c1-3-4-7(2,5)6;/h4H,3H2,1-2H3;1H
InChIKeyBBBYHBIWEUJCFT-UHFFFAOYSA-N
MW159.64 g/mol
LogP-0.02
Rot. Bonds2

About N-ethylmethanesulfonamide;hydrochloride

N-ethylmethanesulfonamide;hydrochloride (PubChem CID 87431036) has the molecular formula C3H10ClNO2S and a molecular weight of 159.64 g/mol. Its IUPAC name is N-ethylmethanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-ethylmethanesulfonamide;hydrochloride
PubChem CID87431036
Molecular FormulaC3H10ClNO2S
Molecular Weight159.64 g/mol
Exact Mass159.01
IUPAC NameN-ethylmethanesulfonamide;hydrochloride
SMILESCCNS(C)(=O)=O.Cl
InChIInChI=1S/C3H9NO2S.ClH/c1-3-4-7(2,5)6;/h4H,3H2,1-2H3;1H
InChIKeyBBBYHBIWEUJCFT-UHFFFAOYSA-N
XLogP-0.02
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.64
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Methanesulfonamide, 1-chloro-N-ethyl-
CID 171110
N-Ethylmethanesulfonamide
CID 5136276
N-propylmethanesulfonamide
CID 235967
N-(2-Chloroethyl)methanesulphonamide
CID 89092
N-(2-Iodoethyl)methanesulfonamide
CID 21344428
N-(2-aminoethyl)methanesulfonamide hydrochloride
CID 22609809
2-amino-N-methylethane-1-sulfonamide hydrochloride
CID 46736945
Ethanaminium mesylate
CID 56927986
N-(2-Aminoethyl)methanesulfonamide
CID 533845
Ethylazanium;methyl-oxido-oxo-sulfanylidene-lambda6-sulfane
CID 21960988
N-methylsulfonylsulfanylethanamine
CID 87551065
1-Chloro-N-propylmethanesulfonamide
CID 3016696

Frequently Asked Questions

What is the IUPAC name of N-ethylmethanesulfonamide;hydrochloride?
The IUPAC name of N-ethylmethanesulfonamide;hydrochloride (CID 87431036) is N-ethylmethanesulfonamide;hydrochloride.
What is the SMILES notation for N-ethylmethanesulfonamide;hydrochloride?
The canonical SMILES for N-ethylmethanesulfonamide;hydrochloride is CCNS(C)(=O)=O.Cl.
What is the InChIKey of N-ethylmethanesulfonamide;hydrochloride?
The InChIKey is BBBYHBIWEUJCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO2S.ClH/c1-3-4-7(2,5)6;/h4H,3H2,1-2H3;1H.
What are the key properties of N-ethylmethanesulfonamide;hydrochloride?
N-ethylmethanesulfonamide;hydrochloride has a molecular weight of 159.64 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylmethanesulfonamide;hydrochloride is sourced from PubChem (CID 87431036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).