N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide

C11H24N2O2S — CID 106608119

IUPACN-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
SMILESCCN(CC1CCCN1)S(=O)(=O)CC(C)C
InChIInChI=1S/C11H24N2O2S/c1-4-13(8-11-6-5-7-12-11)16(14,15)9-10(2)3/h10-12H,4-9H2,1-3H3
InChIKeyXLBPMDNETDLVOA-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.05
Rot. Bonds6

About N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide

N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide (PubChem CID 106608119) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
PubChem CID106608119
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
SMILESCCN(CC1CCCN1)S(=O)(=O)CC(C)C
InChIInChI=1S/C11H24N2O2S/c1-4-13(8-11-6-5-7-12-11)16(14,15)9-10(2)3/h10-12H,4-9H2,1-3H3
InChIKeyXLBPMDNETDLVOA-UHFFFAOYSA-N
XLogP1.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyano-N-ethyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106607994
N,2-dimethyl-N-(piperidin-2-ylmethyl)propane-1-sulfonamide
CID 106630556
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
CID 106608788
N-(diethylsulfamoyl)-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106630194
N,N-diethyl-2-pyrrolidin-2-ylethanesulfonamide
CID 115040519
N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 43265935
N-ethyl-4-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608209
N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608211
1-methylsulfonyl-N-propyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608529
N-butyl-N-(pyrrolidin-2-ylmethyl)prop-2-ene-1-sulfonamide
CID 106609362
N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106603221
N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 43274680

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide?
The IUPAC name of N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide (CID 106608119) is N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide.
What is the SMILES notation for N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide?
The canonical SMILES for N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide is CCN(CC1CCCN1)S(=O)(=O)CC(C)C.
What is the InChIKey of N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide?
The InChIKey is XLBPMDNETDLVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-4-13(8-11-6-5-7-12-11)16(14,15)9-10(2)3/h10-12H,4-9H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide?
N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide is sourced from PubChem (CID 106608119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).