N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine

C12H19N3O2S — CID 103302961

IUPACN-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
SMILESCCNc1cccnc1S(=O)(=O)N1CCCC1C
InChIInChI=1S/C12H19N3O2S/c1-3-13-11-7-4-8-14-12(11)18(16,17)15-9-5-6-10(15)2/h4,7-8,10,13H,3,5-6,9H2,1-2H3
InChIKeyRPANBDLFANNQCX-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.69
Rot. Bonds4

About N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine

N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine (PubChem CID 103302961) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
PubChem CID103302961
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine
SMILESCCNc1cccnc1S(=O)(=O)N1CCCC1C
InChIInChI=1S/C12H19N3O2S/c1-3-13-11-7-4-8-14-12(11)18(16,17)15-9-5-6-10(15)2/h4,7-8,10,13H,3,5-6,9H2,1-2H3
InChIKeyRPANBDLFANNQCX-UHFFFAOYSA-N
XLogP1.69
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethylpiperidin-1-yl)sulfonyl-N-ethylpyridin-3-amine
CID 103306376
2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-ylsulfonyl)-N-ethylpyridin-3-amine
CID 103305199
N-ethyl-2-(3-propan-2-ylpyrrolidin-1-yl)sulfonylpyridin-3-amine
CID 103307176
N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylsulfonyl)pyridin-3-amine
CID 103306417
2-(3-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303754
3-(ethylamino)-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-2-sulfonamide
CID 103303867
3-(ethylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2-sulfonamide
CID 103305202
N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
2-(4-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303589
2-[[3-(ethylamino)-2-pyridinyl]sulfonyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-ol
CID 103307057
[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylsulfonyl)-3-pyridinyl]hydrazine
CID 103301021
[1-[[3-(methylamino)-2-pyridinyl]sulfonyl]piperidin-2-yl]methanol
CID 103305482

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine?
The IUPAC name of N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine (CID 103302961) is N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine.
What is the SMILES notation for N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine?
The canonical SMILES for N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine is CCNc1cccnc1S(=O)(=O)N1CCCC1C.
What is the InChIKey of N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine?
The InChIKey is RPANBDLFANNQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-3-13-11-7-4-8-14-12(11)18(16,17)15-9-5-6-10(15)2/h4,7-8,10,13H,3,5-6,9H2,1-2H3.
What are the key properties of N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine?
N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine has a molecular weight of 269.37 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methylpyrrolidin-1-yl)sulfonylpyridin-3-amine is sourced from PubChem (CID 103302961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).