2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide

C12H17N3O2S — CID 64522432

IUPAC2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)N(CC2CC2)C2CC2)ccn1
InChIInChI=1S/C12H17N3O2S/c13-12-7-11(5-6-14-12)18(16,17)15(10-3-4-10)8-9-1-2-9/h5-7,9-10H,1-4,8H2,(H2,13,14)
InChIKeyIYKBDMJWJCZOSE-UHFFFAOYSA-N
MW267.35 g/mol
LogP1.23
Rot. Bonds5

About 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide

2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide (PubChem CID 64522432) has the molecular formula C12H17N3O2S and a molecular weight of 267.35 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide
PubChem CID64522432
Molecular FormulaC12H17N3O2S
Molecular Weight267.35 g/mol
Exact Mass267.10
IUPAC Name2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide
SMILESNc1cc(S(=O)(=O)N(CC2CC2)C2CC2)ccn1
InChIInChI=1S/C12H17N3O2S/c13-12-7-11(5-6-14-12)18(16,17)15(10-3-4-10)8-9-1-2-9/h5-7,9-10H,1-4,8H2,(H2,13,14)
InChIKeyIYKBDMJWJCZOSE-UHFFFAOYSA-N
XLogP1.23
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[4-[(dimethylamino)methyl]piperidin-1-yl]sulfonylpyridin-2-amine
CID 62156937
5,6-dichloro-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-3-sulfonamide
CID 64606326
N-cyclopropyl-N-(cyclopropylmethyl)-4-(ethylamino)benzenesulfonamide
CID 64522429
5-[cyclopropyl(cyclopropylmethyl)sulfamoyl]-2-fluorobenzenecarbothioamide
CID 64521555
N-cyclopropyl-N-(cyclopropylmethyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64523018
2-amino-N-(cyclohexylmethyl)-N-cyclopropylpyridine-3-sulfonamide
CID 65427611
4-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonylpyridin-2-amine
CID 62152115
2-amino-N-methyl-N-(oxolan-3-yl)pyridine-4-sulfonamide
CID 82743975
3-amino-N-cyclopropyl-N-(cyclopropylmethyl)-5-fluoro-4-methoxybenzenesulfonamide
CID 114625777
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-4-sulfonamide
CID 62978743
N-cyclopropyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144804
N-cyclopropyl-N-(piperidin-4-ylmethyl)benzenesulfonamide
CID 79717324

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide?
The IUPAC name of 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide (CID 64522432) is 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide?
The canonical SMILES for 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide is Nc1cc(S(=O)(=O)N(CC2CC2)C2CC2)ccn1.
What is the InChIKey of 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide?
The InChIKey is IYKBDMJWJCZOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2S/c13-12-7-11(5-6-14-12)18(16,17)15(10-3-4-10)8-9-1-2-9/h5-7,9-10H,1-4,8H2,(H2,13,14).
What are the key properties of 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide?
2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide has a molecular weight of 267.35 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-N-(cyclopropylmethyl)pyridine-4-sulfonamide is sourced from PubChem (CID 64522432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).