4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide

C19H17N5O2S — CID 122184282

IUPAC4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1
InChIInChI=1S/C19H17N5O2S/c1-13-3-5-16(6-4-13)27(25,26)23-19-17-9-14(15-11-22-24(2)12-15)10-21-18(17)7-8-20-19/h3-12H,1-2H3,(H,20,23)
InChIKeyZUUJQTVCVABGDN-UHFFFAOYSA-N
MW379.45 g/mol
LogP3.14
Rot. Bonds4

About 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide

4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide (PubChem CID 122184282) has the molecular formula C19H17N5O2S and a molecular weight of 379.45 g/mol. Its IUPAC name is 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide.

Molecular Properties

Compound Name4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide
PubChem CID122184282
Molecular FormulaC19H17N5O2S
Molecular Weight379.45 g/mol
Exact Mass379.11
IUPAC Name4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1
InChIInChI=1S/C19H17N5O2S/c1-13-3-5-16(6-4-13)27(25,26)23-19-17-9-14(15-11-22-24(2)12-15)10-21-18(17)7-8-20-19/h3-12H,1-2H3,(H,20,23)
InChIKeyZUUJQTVCVABGDN-UHFFFAOYSA-N
XLogP3.14
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.45
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide?
The IUPAC name of 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide (CID 122184282) is 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide.
What is the SMILES notation for 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide?
The canonical SMILES for 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide is Cc1ccc(S(=O)(=O)Nc2nccc3ncc(-c4cnn(C)c4)cc23)cc1.
What is the InChIKey of 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide?
The InChIKey is ZUUJQTVCVABGDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2S/c1-13-3-5-16(6-4-13)27(25,26)23-19-17-9-14(15-11-22-24(2)12-15)10-21-18(17)7-8-20-19/h3-12H,1-2H3,(H,20,23).
What are the key properties of 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide?
4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide has a molecular weight of 379.45 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[3-(1-methylpyrazol-4-yl)-1,6-naphthyridin-5-yl]benzenesulfonamide is sourced from PubChem (CID 122184282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).