5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine

C14H18N4O2S — CID 113016392

IUPAC5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine
SMILESCc1ccc(Nc2ccc(NS(=O)(=O)N(C)C)cn2)cc1
InChIInChI=1S/C14H18N4O2S/c1-11-4-6-12(7-5-11)16-14-9-8-13(10-15-14)17-21(19,20)18(2)3/h4-10,17H,1-3H3,(H,15,16)
InChIKeyRGMFFIAFMVNWDM-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.35
Rot. Bonds5

About 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine

5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine (PubChem CID 113016392) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine.

Molecular Properties

Compound Name5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine
PubChem CID113016392
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC Name5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine
SMILESCc1ccc(Nc2ccc(NS(=O)(=O)N(C)C)cn2)cc1
InChIInChI=1S/C14H18N4O2S/c1-11-4-6-12(7-5-11)16-14-9-8-13(10-15-14)17-21(19,20)18(2)3/h4-10,17H,1-3H3,(H,15,16)
InChIKeyRGMFFIAFMVNWDM-UHFFFAOYSA-N
XLogP2.35
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(dimethylsulfamoylamino)-2-(methylamino)pyridine
CID 115268515
2-(4-bromo-2-methylanilino)-5-(dimethylsulfamoylamino)pyridine
CID 113021518
2-(dimethylsulfamoylamino)-5-(2,4,6-trimethylanilino)pyridine
CID 113032840
5-(dimethylsulfamoylamino)-2-(2-methoxyanilino)pyridine
CID 113019343
5-(dimethylsulfamoylamino)-2-(2-propan-2-yloxyanilino)pyridine
CID 113019877
N-[6-[4-(dimethylamino)anilino]-3-pyridinyl]-2,4-dimethylbenzenesulfonamide
CID 113020920
N-(4-methylphenyl)-5-nitrosopyridin-2-amine
CID 138981164
2-(dimethylsulfamoylamino)-5-(propylamino)pyridine
CID 113023494
5-(dimethylsulfamoylamino)-2-[(4-fluorophenyl)methylamino]pyridine
CID 113012162
methyl 4-[[6-(dimethylsulfamoylamino)-3-pyridinyl]amino]benzoate
CID 113035429
5-[2-(dimethylamino)ethylamino]-2-(dimethylsulfamoylamino)pyridine
CID 113025561
2-(dimethylsulfamoylamino)-5-(2-methylpropylamino)pyridine
CID 113024164

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine?
The IUPAC name of 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine (CID 113016392) is 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine.
What is the SMILES notation for 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine?
The canonical SMILES for 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine is Cc1ccc(Nc2ccc(NS(=O)(=O)N(C)C)cn2)cc1.
What is the InChIKey of 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine?
The InChIKey is RGMFFIAFMVNWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c1-11-4-6-12(7-5-11)16-14-9-8-13(10-15-14)17-21(19,20)18(2)3/h4-10,17H,1-3H3,(H,15,16).
What are the key properties of 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine?
5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine has a molecular weight of 306.39 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylsulfamoylamino)-2-(4-methylanilino)pyridine is sourced from PubChem (CID 113016392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).