6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide

C12H20N4O2S — CID 103341119

IUPAC6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NC2CCCC2N)nc1
InChIInChI=1S/C12H20N4O2S/c1-16(2)19(17,18)9-6-7-12(14-8-9)15-11-5-3-4-10(11)13/h6-8,10-11H,3-5,13H2,1-2H3,(H,14,15)
InChIKeyODVALOCTKMCEDX-UHFFFAOYSA-N
MW284.39 g/mol
LogP0.62
Rot. Bonds4

About 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide

6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide (PubChem CID 103341119) has the molecular formula C12H20N4O2S and a molecular weight of 284.39 g/mol. Its IUPAC name is 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide
PubChem CID103341119
Molecular FormulaC12H20N4O2S
Molecular Weight284.39 g/mol
Exact Mass284.13
IUPAC Name6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(NC2CCCC2N)nc1
InChIInChI=1S/C12H20N4O2S/c1-16(2)19(17,18)9-6-7-12(14-8-9)15-11-5-3-4-10(11)13/h6-8,10-11H,3-5,13H2,1-2H3,(H,14,15)
InChIKeyODVALOCTKMCEDX-UHFFFAOYSA-N
XLogP0.62
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.39
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[[2-(chloromethyl)cyclohexyl]amino]-N,N-dimethylpyridine-3-sulfonamide
CID 106365560
6-[[2-(hydroxymethyl)cyclohexyl]amino]-N,N-dimethylpyridine-3-sulfonamide
CID 106362373
6-[(2-ethylsulfanylcyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103804893
cis-(1S,2R)-1-N-(5-methyl-2-pyridinyl)cyclopentane-1,2-diamine
CID 159909589
6-[(4-hydroxycyclohexyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103623850
6-[[(1R,2R)-2-aminocyclohexyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 102738868
6-(1-cyclobutylethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 103850302
N,N-dimethyl-6-(pyrrolidin-3-ylamino)pyridine-3-sulfonamide
CID 103341109
6-(cyclopropylmethylamino)-N,N-dimethylpyridine-3-sulfonamide
CID 113234561
cis-(1R,2S)-2-N-(5-bromo-2-pyridinyl)cyclohexane-1,2-diamine
CID 93453964
2-N-(5-iodo-2-pyridinyl)cyclohexane-1,2-diamine
CID 58464157
N,N-dimethyl-6-(pyrrolidin-2-ylmethylamino)pyridine-3-sulfonamide
CID 103341110

Frequently Asked Questions

What is the IUPAC name of 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide?
The IUPAC name of 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide (CID 103341119) is 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide.
What is the SMILES notation for 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide?
The canonical SMILES for 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide is CN(C)S(=O)(=O)c1ccc(NC2CCCC2N)nc1.
What is the InChIKey of 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide?
The InChIKey is ODVALOCTKMCEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-16(2)19(17,18)9-6-7-12(14-8-9)15-11-5-3-4-10(11)13/h6-8,10-11H,3-5,13H2,1-2H3,(H,14,15).
What are the key properties of 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide?
6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide has a molecular weight of 284.39 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-aminocyclopentyl)amino]-N,N-dimethylpyridine-3-sulfonamide is sourced from PubChem (CID 103341119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).