1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide

C10H25N3O2S — CID 106055954

IUPAC1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NCCN(C)CC
InChIInChI=1S/C10H25N3O2S/c1-5-11-9-10(3)16(14,15)12-7-8-13(4)6-2/h10-12H,5-9H2,1-4H3
InChIKeyAOLBTUBIVMEIHY-UHFFFAOYSA-N
MW251.40 g/mol
LogP-0.14
Rot. Bonds9

About 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide

1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide (PubChem CID 106055954) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide.

Molecular Properties

Compound Name1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide
PubChem CID106055954
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NCCN(C)CC
InChIInChI=1S/C10H25N3O2S/c1-5-11-9-10(3)16(14,15)12-7-8-13(4)6-2/h10-12H,5-9H2,1-4H3
InChIKeyAOLBTUBIVMEIHY-UHFFFAOYSA-N
XLogP-0.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide
CID 106017341
N-(3,3-dimethylbutyl)-1-(ethylamino)propane-2-sulfonamide
CID 106085654
3-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]-2-methylpropanamide
CID 62838043
1-(ethylamino)-N-(6-methylsulfanylhexyl)propane-2-sulfonamide
CID 106090471
1-(ethylamino)-N-[2-(3-methoxyphenyl)ethyl]propane-2-sulfonamide
CID 106087679
1-(ethylamino)-N-[(1-methylcyclohexyl)methyl]propane-2-sulfonamide
CID 114095179
1-(ethylamino)-N-(2-pyrrolidin-1-ylpropyl)propane-2-sulfonamide
CID 106073122
1-(ethylamino)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]propane-2-sulfonamide
CID 114185435
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-1-(ethylamino)propane-2-sulfonamide
CID 103192324
N-(3,3-dimethylbutyl)-1-(propylamino)propane-2-sulfonamide
CID 114142376
N-[2-[ethyl(methyl)amino]ethyl]-2-hydroxyethanesulfonamide
CID 79579543
1-(cyclopropylamino)-N-[2-[cyclopropyl(ethyl)amino]ethyl]propane-2-sulfonamide
CID 106094033

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide?
The IUPAC name of 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide (CID 106055954) is 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide.
What is the SMILES notation for 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide?
The canonical SMILES for 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide is CCNCC(C)S(=O)(=O)NCCN(C)CC.
What is the InChIKey of 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide?
The InChIKey is AOLBTUBIVMEIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-5-11-9-10(3)16(14,15)12-7-8-13(4)6-2/h10-12H,5-9H2,1-4H3.
What are the key properties of 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide?
1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide has a molecular weight of 251.40 g/mol, XLogP of -0.14, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide is sourced from PubChem (CID 106055954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).