(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine

C8H18N2O2S — CID 67580808

IUPAC(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine
SMILESCCN(C)[C@@H]1CCN(S(C)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-4-9(2)8-5-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3/t8-/m1/s1
InChIKeyUUHLLDAVSCDNRE-MRVPVSSYSA-N
MW206.31 g/mol
LogP-0.03
Rot. Bonds3

About (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine

(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine (PubChem CID 67580808) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine
PubChem CID67580808
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC Name(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine
SMILESCCN(C)[C@@H]1CCN(S(C)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-4-9(2)8-5-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3/t8-/m1/s1
InChIKeyUUHLLDAVSCDNRE-MRVPVSSYSA-N
XLogP-0.03
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1-methylsulfonylpyrrolidin-3-amine
CID 154745000
1-methyl-1-(1-methylsulfonylpyrrolidin-3-yl)thiourea
CID 130597845
dimethyl 5-[(3R)-3-[ethyl(methyl)amino]pyrrolidin-1-yl]sulfonylbenzene-1,3-dicarboxylate
CID 99799663
1-[3-(3,5-difluorophenyl)-3-(1-methylsulfonylpiperidin-4-yl)propyl]-N-ethyl-N-methylpiperidin-4-amine
CID 143249595
1-methylsulfonylpyrrolidin-3-ol
CID 20745843
(3R)-1-methylsulfonylpyrrolidin-3-ol
CID 78998740
2-chloro-5-[(3R)-3-[ethyl(methyl)amino]pyrrolidin-1-yl]sulfonylbenzonitrile
CID 99799665
3-(4-bromophenyl)-1-methylsulfonylpyrrolidine;N,N-diethylethanamine
CID 90421780
3-[ethyl(methyl)amino]-N,N-dimethylpyrrolidine-1-carboxamide
CID 166901348
(3S)-1-methylsulfonylpyrrolidin-3-amine;hydrochloride
CID 66672546
ethene;(3R)-1-methylsulfonyl-3-propan-2-ylpyrrolidine
CID 155736359
3-(2,2-dimethylpropyl)-1-methylsulfonylpyrrolidine
CID 59148137

Frequently Asked Questions

What is the IUPAC name of (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine?
The IUPAC name of (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine (CID 67580808) is (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine?
The canonical SMILES for (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine is CCN(C)[C@@H]1CCN(S(C)(=O)=O)C1.
What is the InChIKey of (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine?
The InChIKey is UUHLLDAVSCDNRE-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-4-9(2)8-5-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3/t8-/m1/s1.
What are the key properties of (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine?
(3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine has a molecular weight of 206.31 g/mol, XLogP of -0.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-ethyl-N-methyl-1-methylsulfonylpyrrolidin-3-amine is sourced from PubChem (CID 67580808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).