6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide

C13H21N3O2S — CID 114613617

IUPAC6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide
SMILESCC1(C)C(NS(=O)(=O)c2ccc(CN)nc2)C1(C)C
InChIInChI=1S/C13H21N3O2S/c1-12(2)11(13(12,3)4)16-19(17,18)10-6-5-9(7-14)15-8-10/h5-6,8,11,16H,7,14H2,1-4H3
InChIKeyWDJDBSFIXPYYPH-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.25
Rot. Bonds4

About 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide

6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide (PubChem CID 114613617) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide
PubChem CID114613617
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC Name6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide
SMILESCC1(C)C(NS(=O)(=O)c2ccc(CN)nc2)C1(C)C
InChIInChI=1S/C13H21N3O2S/c1-12(2)11(13(12,3)4)16-19(17,18)10-6-5-9(7-14)15-8-10/h5-6,8,11,16H,7,14H2,1-4H3
InChIKeyWDJDBSFIXPYYPH-UHFFFAOYSA-N
XLogP1.25
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide
CID 79352951
3-(aminomethyl)-4-methyl-N-(2,2,3,3-tetramethylcyclopropyl)benzenesulfonamide
CID 79357481
6-(aminomethyl)-N-(4-methyloxan-4-yl)pyridine-3-sulfonamide
CID 114613753
6-(aminomethyl)-N-(2-sulfamoylethyl)pyridine-3-sulfonamide
CID 114613166
6-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)pyridine-3-sulfonamide
CID 114613735
4-bromo-N-(2,2,3,3-tetramethylcyclopropyl)benzenesulfonamide
CID 79357727
6-(aminomethyl)-N-(1-cyclopentylethyl)pyridine-3-sulfonamide
CID 114613542
6-(aminomethyl)-N-(2-phenylpropyl)pyridine-3-sulfonamide
CID 114613731
6-(aminomethyl)-N-(4-ethoxyphenyl)pyridine-3-sulfonamide
CID 114613079
6-(aminomethyl)-N-(2-ethoxypropyl)pyridine-3-sulfonamide
CID 114613742
2-[[6-(aminomethyl)-3-pyridinyl]sulfonylamino]-N,N-diethylacetamide
CID 114613706
6-(aminomethyl)-N-[(4-fluorophenyl)methyl]pyridine-3-sulfonamide
CID 114613015

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide?
The IUPAC name of 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide (CID 114613617) is 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide is CC1(C)C(NS(=O)(=O)c2ccc(CN)nc2)C1(C)C.
What is the InChIKey of 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide?
The InChIKey is WDJDBSFIXPYYPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-12(2)11(13(12,3)4)16-19(17,18)10-6-5-9(7-14)15-8-10/h5-6,8,11,16H,7,14H2,1-4H3.
What are the key properties of 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide?
6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-3-sulfonamide is sourced from PubChem (CID 114613617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).