N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide

C14H17N3O2S — CID 62156970

IUPACN-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)N(C)c2ccc(C)cc2)ccn1
InChIInChI=1S/C14H17N3O2S/c1-11-4-6-12(7-5-11)17(3)20(18,19)13-8-9-16-14(10-13)15-2/h4-10H,1-3H3,(H,15,16)
InChIKeyVNWHGNNWDXNNCW-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.26
Rot. Bonds4

About N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide

N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide (PubChem CID 62156970) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide
PubChem CID62156970
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)N(C)c2ccc(C)cc2)ccn1
InChIInChI=1S/C14H17N3O2S/c1-11-4-6-12(7-5-11)17(3)20(18,19)13-8-9-16-14(10-13)15-2/h4-10H,1-3H3,(H,15,16)
InChIKeyVNWHGNNWDXNNCW-UHFFFAOYSA-N
XLogP2.26
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide?
The IUPAC name of N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide (CID 62156970) is N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)N(C)c2ccc(C)cc2)ccn1.
What is the InChIKey of N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide?
The InChIKey is VNWHGNNWDXNNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-11-4-6-12(7-5-11)17(3)20(18,19)13-8-9-16-14(10-13)15-2/h4-10H,1-3H3,(H,15,16).
What are the key properties of N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide?
N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide has a molecular weight of 291.38 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide is sourced from PubChem (CID 62156970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).