N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide

C17H17N3O2S — CID 133299071

IUPACN-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(NCc2ccc3ccccc3c2)nc1
InChIInChI=1S/C17H17N3O2S/c1-18-23(21,22)16-8-9-17(20-12-16)19-11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10,12,18H,11H2,1H3,(H,19,20)
InChIKeyIABKQADNMXWQCZ-UHFFFAOYSA-N
MW327.41 g/mol
LogP2.76
Rot. Bonds5

About N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide

N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide (PubChem CID 133299071) has the molecular formula C17H17N3O2S and a molecular weight of 327.41 g/mol. Its IUPAC name is N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide
PubChem CID133299071
Molecular FormulaC17H17N3O2S
Molecular Weight327.41 g/mol
Exact Mass327.10
IUPAC NameN-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(NCc2ccc3ccccc3c2)nc1
InChIInChI=1S/C17H17N3O2S/c1-18-23(21,22)16-8-9-17(20-12-16)19-11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10,12,18H,11H2,1H3,(H,19,20)
InChIKeyIABKQADNMXWQCZ-UHFFFAOYSA-N
XLogP2.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(4-bromo-3-fluorophenyl)methylamino]-N-methylpyridine-3-sulfonamide
CID 133304263
6-[(4-cyanophenyl)methylamino]-N-methylpyridine-3-sulfonamide
CID 133346456
6-[(2-bromophenyl)methylamino]-N-methylpyridine-3-sulfonamide
CID 133304167
5-bromo-N-(naphthalen-2-ylmethyl)pyridin-2-amine
CID 115146732
6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
N-methyl-6-[(4-morpholin-4-ylphenyl)methylamino]pyridine-3-sulfonamide
CID 133298461
2-methyl-N-[3-[[[5-(methylsulfamoyl)-2-pyridinyl]amino]methyl]phenyl]butanamide
CID 133297158
N-methyl-3-[[(5-piperidin-1-ylsulfonyl-2-pyridinyl)amino]methyl]benzenesulfonamide
CID 55680935
N-methyl-6-(naphthalen-2-ylmethylamino)pyridazine-3-carboxamide
CID 133328883
N-tert-butyl-6-[(3-fluoro-4-methylphenyl)methylamino]pyridine-3-sulfonamide
CID 112806919
N-(cyclopropylmethyl)-6-[(3-methylphenyl)methylamino]pyridine-3-sulfonamide
CID 133316561
N-benzyl-6-(propylamino)pyridine-3-sulfonamide
CID 62148374

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide?
The IUPAC name of N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide (CID 133299071) is N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide is CNS(=O)(=O)c1ccc(NCc2ccc3ccccc3c2)nc1.
What is the InChIKey of N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide?
The InChIKey is IABKQADNMXWQCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2S/c1-18-23(21,22)16-8-9-17(20-12-16)19-11-13-6-7-14-4-2-3-5-15(14)10-13/h2-10,12,18H,11H2,1H3,(H,19,20).
What are the key properties of N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide?
N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide has a molecular weight of 327.41 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(naphthalen-2-ylmethylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 133299071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).