N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride

C10H22ClN3O3S — CID 119491039

IUPACN-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride
SMILESCNC1CCCN(C(=O)CN(C)S(C)(=O)=O)C1.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-11-9-5-4-6-13(7-9)10(14)8-12(2)17(3,15)16;/h9,11H,4-8H2,1-3H3;1H
InChIKeyXGYFZMOWQWIMAG-UHFFFAOYSA-N
MW299.82 g/mol
LogP-0.49
Rot. Bonds4

About N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride

N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride (PubChem CID 119491039) has the molecular formula C10H22ClN3O3S and a molecular weight of 299.82 g/mol. Its IUPAC name is N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride
PubChem CID119491039
Molecular FormulaC10H22ClN3O3S
Molecular Weight299.82 g/mol
Exact Mass299.11
IUPAC NameN-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride
SMILESCNC1CCCN(C(=O)CN(C)S(C)(=O)=O)C1.Cl
InChIInChI=1S/C10H21N3O3S.ClH/c1-11-9-5-4-6-13(7-9)10(14)8-12(2)17(3,15)16;/h9,11H,4-8H2,1-3H3;1H
InChIKeyXGYFZMOWQWIMAG-UHFFFAOYSA-N
XLogP-0.49
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.82
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]ethanesulfonamide
CID 119489915
N,3,4-trimethyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]benzenesulfonamide;hydrochloride
CID 119491114
1-[(3S)-3-(methylamino)piperidin-1-yl]propan-1-one
CID 94475711
3,3,3-trifluoro-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119490768
N,N-diethyl-2-[3-(methylamino)piperidin-1-yl]-2-oxoethanesulfonamide
CID 119493899
2-chloro-1-[(3R)-3-(methylamino)piperidin-1-yl]ethanone
CID 58168404
2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119260330
2-cyclobutyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119488548
N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]-3-nitrobenzenesulfonamide
CID 119489842
N-methyl-N-[2-oxo-2-[3-(pyrimidin-2-ylamino)azetidin-1-yl]ethyl]methanesulfonamide
CID 121187533
1-[(3S)-3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 172646124
3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119260323

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride?
The IUPAC name of N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride (CID 119491039) is N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride.
What is the SMILES notation for N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride?
The canonical SMILES for N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride is CNC1CCCN(C(=O)CN(C)S(C)(=O)=O)C1.Cl.
What is the InChIKey of N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride?
The InChIKey is XGYFZMOWQWIMAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S.ClH/c1-11-9-5-4-6-13(7-9)10(14)8-12(2)17(3,15)16;/h9,11H,4-8H2,1-3H3;1H.
What are the key properties of N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride?
N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride has a molecular weight of 299.82 g/mol, XLogP of -0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]methanesulfonamide;hydrochloride is sourced from PubChem (CID 119491039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).