6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide

C12H19N3O2S — CID 62157833

IUPAC6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide
SMILESCCCCN(C1CC1)S(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H19N3O2S/c1-2-3-8-15(10-4-5-10)18(16,17)11-6-7-12(13)14-9-11/h6-7,9-10H,2-5,8H2,1H3,(H2,13,14)
InChIKeyCWOGQBPHPQHZRY-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.62
Rot. Bonds6

About 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide

6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide (PubChem CID 62157833) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide
PubChem CID62157833
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide
SMILESCCCCN(C1CC1)S(=O)(=O)c1ccc(N)nc1
InChIInChI=1S/C12H19N3O2S/c1-2-3-8-15(10-4-5-10)18(16,17)11-6-7-12(13)14-9-11/h6-7,9-10H,2-5,8H2,1H3,(H2,13,14)
InChIKeyCWOGQBPHPQHZRY-UHFFFAOYSA-N
XLogP1.62
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-N-cyclopropyl-6-(propylamino)pyridine-3-sulfonamide
CID 62156743
3-amino-N-butyl-N-cyclopropyl-4-methylbenzenesulfonamide
CID 61112985
N-butyl-N-cyclopropyl-4-fluorobenzenesulfonamide
CID 60751133
6-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 62158435
3-(aminomethyl)-N-butyl-N-cyclopropyl-4-fluorobenzenesulfonamide
CID 63288985
3-[butyl(cyclopropyl)sulfamoyl]benzenesulfonyl fluoride
CID 114791465
2-amino-N-butyl-N-cyclopropyl-3,6-dimethylbenzenesulfonamide
CID 103171231
N-butyl-N-cyclopropyl-2,3-dihydro-1H-isoindole-5-sulfonamide
CID 107421960
6-chloro-N-cyclopropyl-N-ethylpyridine-3-sulfonamide
CID 43243310
5-butylsulfonylpyridin-2-amine
CID 90010131
3-amino-N-butyl-5-chloro-N-cyclopropyl-4-methylbenzenesulfonamide
CID 61113158
3-amino-N-butyl-N-cyclopropyl-2,4-difluorobenzenesulfonamide
CID 107343278

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide (CID 62157833) is 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide is CCCCN(C1CC1)S(=O)(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide?
The InChIKey is CWOGQBPHPQHZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-2-3-8-15(10-4-5-10)18(16,17)11-6-7-12(13)14-9-11/h6-7,9-10H,2-5,8H2,1H3,(H2,13,14).
What are the key properties of 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide?
6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-butyl-N-cyclopropylpyridine-3-sulfonamide is sourced from PubChem (CID 62157833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).