N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide

C10H25N3O2S — CID 106017341

IUPACN-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NCC(C)N(C)C
InChIInChI=1S/C10H25N3O2S/c1-6-11-8-10(3)16(14,15)12-7-9(2)13(4)5/h9-12H,6-8H2,1-5H3
InChIKeyADYLHEXWDOYWTP-UHFFFAOYSA-N
MW251.40 g/mol
LogP-0.15
Rot. Bonds8

About N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide

N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide (PubChem CID 106017341) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide
PubChem CID106017341
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC NameN-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NCC(C)N(C)C
InChIInChI=1S/C10H25N3O2S/c1-6-11-8-10(3)16(14,15)12-7-9(2)13(4)5/h9-12H,6-8H2,1-5H3
InChIKeyADYLHEXWDOYWTP-UHFFFAOYSA-N
XLogP-0.15
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)propyl]-1-(propan-2-ylamino)propane-2-sulfonamide
CID 114137559
N-[2-(dimethylamino)propyl]propane-2-sulfonamide
CID 61357181
1-(ethylamino)-N-[2-[ethyl(methyl)amino]ethyl]propane-2-sulfonamide
CID 106055954
1-(ethylamino)-N-(2-pyrrolidin-1-ylpropyl)propane-2-sulfonamide
CID 106073122
N-(3,3-dimethylbutyl)-1-(ethylamino)propane-2-sulfonamide
CID 106085654
1-(ethylamino)-N-[(1-methylcyclohexyl)methyl]propane-2-sulfonamide
CID 114095179
1-(ethylamino)-N-(6-methylsulfanylhexyl)propane-2-sulfonamide
CID 106090471
N-[2-(dimethylamino)propyl]-4-(ethylaminomethyl)piperidine-1-sulfonamide
CID 106017143
N-[(4-chlorophenyl)methyl]-1-(ethylamino)propane-2-sulfonamide
CID 106023482
1-(ethylamino)-N-[(4-fluoro-3,5-dimethylphenyl)methyl]propane-2-sulfonamide
CID 106072908
1-(ethylamino)-N-(1H-pyrazol-4-ylmethyl)propane-2-sulfonamide
CID 106016143
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-1-(ethylamino)propane-2-sulfonamide
CID 103192324

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide (CID 106017341) is N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide is CCNCC(C)S(=O)(=O)NCC(C)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide?
The InChIKey is ADYLHEXWDOYWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-6-11-8-10(3)16(14,15)12-7-9(2)13(4)5/h9-12H,6-8H2,1-5H3.
What are the key properties of N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide?
N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide has a molecular weight of 251.40 g/mol, XLogP of -0.15, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)propyl]-1-(ethylamino)propane-2-sulfonamide is sourced from PubChem (CID 106017341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).