N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide

C12H14N4O2S — CID 106936960

IUPACN-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)N(C)c1ccncc1
InChIInChI=1S/C12H14N4O2S/c1-13-11-4-3-7-15-12(11)19(17,18)16(2)10-5-8-14-9-6-10/h3-9,13H,1-2H3
InChIKeyKDCLOGOLBPEGPJ-UHFFFAOYSA-N
MW278.34 g/mol
LogP1.34
Rot. Bonds4

About N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide

N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide (PubChem CID 106936960) has the molecular formula C12H14N4O2S and a molecular weight of 278.34 g/mol. Its IUPAC name is N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide
PubChem CID106936960
Molecular FormulaC12H14N4O2S
Molecular Weight278.34 g/mol
Exact Mass278.08
IUPAC NameN-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide
SMILESCNc1cccnc1S(=O)(=O)N(C)c1ccncc1
InChIInChI=1S/C12H14N4O2S/c1-13-11-4-3-7-15-12(11)19(17,18)16(2)10-5-8-14-9-6-10/h3-9,13H,1-2H3
InChIKeyKDCLOGOLBPEGPJ-UHFFFAOYSA-N
XLogP1.34
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(methylamino)-N-(2-methylpropyl)-N-propan-2-ylpyridine-2-sulfonamide
CID 103305564
N-(2-hydroxyethyl)-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103304973
N-[3-(dimethylamino)propyl]-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103306050
N-methyl-3-(methylamino)-N-(2-methylsulfonylethyl)pyridine-2-sulfonamide
CID 103306504
3-(methylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303450
N-[(4-chlorophenyl)methyl]-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305595
N-[(2-fluorophenyl)methyl]-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305406
N-methyl-3-(methylamino)-N-[(3-methylphenyl)methyl]pyridine-2-sulfonamide
CID 103305698
N-[(3-hydroxycyclobutyl)methyl]-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103306392
N-(1-ethylpiperidin-4-yl)-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305346
3-hydrazinyl-N,N-dimethylpyridine-2-sulfonamide
CID 103300835
N-(2-hydroxy-3-methoxypropyl)-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103305649

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide?
The IUPAC name of N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide (CID 106936960) is N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide.
What is the SMILES notation for N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide?
The canonical SMILES for N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide is CNc1cccnc1S(=O)(=O)N(C)c1ccncc1.
What is the InChIKey of N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide?
The InChIKey is KDCLOGOLBPEGPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2S/c1-13-11-4-3-7-15-12(11)19(17,18)16(2)10-5-8-14-9-6-10/h3-9,13H,1-2H3.
What are the key properties of N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide?
N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide has a molecular weight of 278.34 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(methylamino)-N-pyridin-4-ylpyridine-2-sulfonamide is sourced from PubChem (CID 106936960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).