2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide

C14H23N3O2S — CID 79356890

IUPAC2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C14H23N3O2S/c1-13(2)11(14(13,3)4)9-17-20(18,19)10-7-6-8-16-12(10)15-5/h6-8,11,17H,9H2,1-5H3,(H,15,16)
InChIKeyGQYJAGYHKHNVOE-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.08
Rot. Bonds5

About 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide

2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide (PubChem CID 79356890) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
PubChem CID79356890
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NCC1C(C)(C)C1(C)C
InChIInChI=1S/C14H23N3O2S/c1-13(2)11(14(13,3)4)9-17-20(18,19)10-7-6-8-16-12(10)15-5/h6-8,11,17H,9H2,1-5H3,(H,15,16)
InChIKeyGQYJAGYHKHNVOE-UHFFFAOYSA-N
XLogP2.08
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopentylmethyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62145518
2-(methylamino)-N-(oxolan-3-ylmethyl)pyridine-3-sulfonamide
CID 62824766
2-(methylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 62149939
N-cyclopropyl-2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]acetamide
CID 62146294
N-[(4-ethylphenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 106900712
N-(3-ethoxypropyl)-2-(methylamino)pyridine-3-sulfonamide
CID 55043958
N-[(4-chlorophenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 62164717
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 105420260
2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
CID 79350502
N-(2-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62144368
2-(methylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 63247729
2-(methylamino)-N-[(3-methylphenyl)methyl]pyridine-3-sulfonamide
CID 62146869

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide (CID 79356890) is 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)NCC1C(C)(C)C1(C)C.
What is the InChIKey of 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide?
The InChIKey is GQYJAGYHKHNVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-13(2)11(14(13,3)4)9-17-20(18,19)10-7-6-8-16-12(10)15-5/h6-8,11,17H,9H2,1-5H3,(H,15,16).
What are the key properties of 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide?
2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 79356890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).