6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide

C12H21N3O3S — CID 106284185

IUPAC6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide
SMILESCCC(CC)C(O)CNS(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H21N3O3S/c1-3-9(4-2)11(16)8-15-19(17,18)10-5-6-12(13)14-7-10/h5-7,9,11,15-16H,3-4,8H2,1-2H3,(H2,13,14)
InChIKeyUKVRUNDQFZDIBW-UHFFFAOYSA-N
MW287.38 g/mol
LogP0.74
Rot. Bonds7

About 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide

6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide (PubChem CID 106284185) has the molecular formula C12H21N3O3S and a molecular weight of 287.38 g/mol. Its IUPAC name is 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide
PubChem CID106284185
Molecular FormulaC12H21N3O3S
Molecular Weight287.38 g/mol
Exact Mass287.13
IUPAC Name6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide
SMILESCCC(CC)C(O)CNS(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H21N3O3S/c1-3-9(4-2)11(16)8-15-19(17,18)10-5-6-12(13)14-7-10/h5-7,9,11,15-16H,3-4,8H2,1-2H3,(H2,13,14)
InChIKeyUKVRUNDQFZDIBW-UHFFFAOYSA-N
XLogP0.74
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.38
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-N-(3-hydroxy-2-methylpropyl)pyridine-3-sulfonamide
CID 65036692
6-amino-N-(3-methyl-2-propan-2-ylbutyl)pyridine-3-sulfonamide
CID 102903322
6-amino-N-pentan-3-ylpyridine-3-sulfonamide
CID 62148993
N-(3-ethyl-2-hydroxypentyl)-1H-pyrrole-3-sulfonamide
CID 106288400
N-(2-hydroxy-3-methylpentyl)-6-(trifluoromethyl)pyridine-3-sulfonamide
CID 75476540
6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]pyridine-3-sulfonamide
CID 106368950
4-amino-N-(3-ethyl-2-hydroxypentyl)-2,6-dimethylbenzenesulfonamide
CID 106284209
1-[(6-amino-3-pyridinyl)sulfonyl]-3-ethylurea
CID 116645965
3-chloro-N-(3-ethyl-2-hydroxypentyl)-4-methoxybenzenesulfonamide
CID 103835165
6-amino-N-(2-methylsulfanylethyl)pyridine-3-sulfonamide
CID 63963985
6-amino-N-(3,5-dimethylphenyl)pyridine-3-sulfonamide
CID 62145055
6-amino-N-(4-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
CID 113484660

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide (CID 106284185) is 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide is CCC(CC)C(O)CNS(=O)(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide?
The InChIKey is UKVRUNDQFZDIBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3S/c1-3-9(4-2)11(16)8-15-19(17,18)10-5-6-12(13)14-7-10/h5-7,9,11,15-16H,3-4,8H2,1-2H3,(H2,13,14).
What are the key properties of 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide?
6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide has a molecular weight of 287.38 g/mol, XLogP of 0.74, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3-ethyl-2-hydroxypentyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106284185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).