4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide

C13H14N2O3S — CID 669659

IUPAC4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C)cn2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-3-8-13(14-9-10)15-19(16,17)12-6-4-11(18-2)5-7-12/h3-9H,1-2H3,(H,14,15)
InChIKeyZVQCTQDKTJQULO-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.20
Rot. Bonds4

About 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide

4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide (PubChem CID 669659) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide
PubChem CID669659
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(C)cn2)cc1
InChIInChI=1S/C13H14N2O3S/c1-10-3-8-13(14-9-10)15-19(16,17)12-6-4-11(18-2)5-7-12/h3-9H,1-2H3,(H,14,15)
InChIKeyZVQCTQDKTJQULO-UHFFFAOYSA-N
XLogP2.20
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-Dimethoxy-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 1141964
Acetamide, N-hydroxy-2-[[(4-methoxyphenyl)sulfonyl](3-pyridinylmethyl)amino]-
CID 10545870
N-Hydroxy-N~2~-[(4-Methoxyphenyl)sulfonyl]-N~2~-(Pyridin-4-Ylmethyl)glycinamide
CID 10831751
2-Pyridinamine, 4-(4-methoxyphenyl)-
CID 82397500
4-methoxy-N-[2-(4-pyridinyl)ethyl]benzenesulfonamide
CID 688003
1-[(4-Methoxyphenyl)sulfonyl]-4-(3-pyridylmethyl)piperazine
CID 828758
4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 809740
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N,N-dimethyl-benzenesulfonamide
CID 53312065
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-methyl-benzenesulfonamide
CID 53312148
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-cyclopropyl-benzenesulfonamide
CID 67325548
4-ethoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 676047
4-ethoxy-N-pyridin-3-ylbenzenesulfonamide
CID 729504

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide (CID 669659) is 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccc(C)cn2)cc1.
What is the InChIKey of 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide?
The InChIKey is ZVQCTQDKTJQULO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-10-3-8-13(14-9-10)15-19(16,17)12-6-4-11(18-2)5-7-12/h3-9H,1-2H3,(H,14,15).
What are the key properties of 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide?
4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide has a molecular weight of 278.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(5-methyl-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 669659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).