N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride

C9H22ClN3O2S — CID 119977584

IUPACN-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCC(CNC)C1.Cl
InChIInChI=1S/C9H21N3O2S.ClH/c1-4-11(3)15(13,14)12-6-5-9(8-12)7-10-2;/h9-10H,4-8H2,1-3H3;1H
InChIKeyYCHLSRHIIWESOF-UHFFFAOYSA-N
MW271.81 g/mol
LogP0.15
Rot. Bonds5

About N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride

N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride (PubChem CID 119977584) has the molecular formula C9H22ClN3O2S and a molecular weight of 271.81 g/mol. Its IUPAC name is N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride
PubChem CID119977584
Molecular FormulaC9H22ClN3O2S
Molecular Weight271.81 g/mol
Exact Mass271.11
IUPAC NameN-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride
SMILESCCN(C)S(=O)(=O)N1CCC(CNC)C1.Cl
InChIInChI=1S/C9H21N3O2S.ClH/c1-4-11(3)15(13,14)12-6-5-9(8-12)7-10-2;/h9-10H,4-8H2,1-3H3;1H
InChIKeyYCHLSRHIIWESOF-UHFFFAOYSA-N
XLogP0.15
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.81
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide
CID 119977585
N-(cyclopropylmethyl)-N-methyl-3-(methylaminomethyl)piperidine-1-sulfonamide;hydrochloride
CID 119960920
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide
CID 63263786
N-methyl-1-(1-propylsulfonylpyrrolidin-3-yl)methanamine;hydrochloride
CID 119977837
4-(aminomethyl)-N-ethyl-N-methylpiperidine-1-sulfonamide;hydrochloride
CID 119963738
N,N-diethyl-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 63248937
N-methyl-1-(1-pyrrolidin-1-ylsulfonylpyrrolidin-3-yl)methanamine;hydrochloride
CID 119977537
1-(1-butylsulfonylpyrrolidin-3-yl)-N-methylmethanamine
CID 63264016
N-methyl-1-[1-(trifluoromethylsulfonyl)pyrrolidin-3-yl]methanamine
CID 63263924
1-[1-(3,5-dichlorophenyl)sulfonylpyrrolidin-3-yl]-N-methylmethanamine;hydrochloride
CID 119977516
N-methyl-1-[1-(3-methylpiperidin-1-yl)sulfonylpyrrolidin-3-yl]methanamine;hydrochloride
CID 119977939
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-4-(methylaminomethyl)piperidine-1-sulfonamide
CID 103192345

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride?
The IUPAC name of N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride (CID 119977584) is N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride is CCN(C)S(=O)(=O)N1CCC(CNC)C1.Cl.
What is the InChIKey of N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride?
The InChIKey is YCHLSRHIIWESOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2S.ClH/c1-4-11(3)15(13,14)12-6-5-9(8-12)7-10-2;/h9-10H,4-8H2,1-3H3;1H.
What are the key properties of N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride?
N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride has a molecular weight of 271.81 g/mol, XLogP of 0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-3-(methylaminomethyl)pyrrolidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119977584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).