5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine

C24H21N5O2S — CID 172600926

IUPAC5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
SMILESCc1c(-c2nccc3cnc(Nc4ccc(S(C)(=O)=O)cc4)cc23)ccc2nn(C)cc12
InChIInChI=1S/C24H21N5O2S/c1-15-19(8-9-22-21(15)14-29(2)28-22)24-20-12-23(26-13-16(20)10-11-25-24)27-17-4-6-18(7-5-17)32(3,30)31/h4-14H,1-3H3,(H,26,27)
InChIKeyYRNNFYLQNSOKIG-UHFFFAOYSA-N
MW443.53 g/mol
LogP4.64
Rot. Bonds4

About 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine

5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine (PubChem CID 172600926) has the molecular formula C24H21N5O2S and a molecular weight of 443.53 g/mol. Its IUPAC name is 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine.

Molecular Properties

Compound Name5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
PubChem CID172600926
Molecular FormulaC24H21N5O2S
Molecular Weight443.53 g/mol
Exact Mass443.14
IUPAC Name5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
SMILESCc1c(-c2nccc3cnc(Nc4ccc(S(C)(=O)=O)cc4)cc23)ccc2nn(C)cc12
InChIInChI=1S/C24H21N5O2S/c1-15-19(8-9-22-21(15)14-29(2)28-22)24-20-12-23(26-13-16(20)10-11-25-24)27-17-4-6-18(7-5-17)32(3,30)31/h4-14H,1-3H3,(H,26,27)
InChIKeyYRNNFYLQNSOKIG-UHFFFAOYSA-N
XLogP4.64
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.53
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[4-methyl-2-(pyrrolidin-3-ylmethyl)indazol-5-yl]-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
CID 172600813
5-[4-ethenyl-2-(2-trimethylsilylethoxymethyl)indazol-5-yl]-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
CID 172601029
5-iodo-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
CID 172600310
N-(4-methylsulfonylphenyl)-5-[4-methyl-2-(2-trimethylsilylethoxymethyl)pyrazolo[3,4-c]pyridin-5-yl]-2,6-naphthyridin-3-amine
CID 172600324
N-(4-methylsulfonylphenyl)-5-(1,2,3,6-tetrahydropyridin-4-yl)-2,6-naphthyridin-3-amine
CID 172600767
1-methyl-3-[7-(4-methylsulfonylanilino)-2,6-naphthyridin-1-yl]cyclohex-2-en-1-ol
CID 172601080
N-(4-methylsulfonylphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-6-yl)-2,6-naphthyridin-3-amine
CID 172600109
4-[[5-[4-methyl-1-[3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propyl]indazol-5-yl]-2,6-naphthyridin-3-yl]amino]benzenesulfonamide
CID 172600752
5-[2-(3,5-dimethylpyrazin-2-yl)ethynyl]-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine
CID 172600763
N-(4,6-difluoropyrimidin-2-yl)-4-[[5-[1-(2-hydroxy-2-methylpropyl)-4-methylindazol-5-yl]-2,6-naphthyridin-3-yl]amino]benzenesulfonamide
CID 172600868
N-(4-fluoropyrimidin-2-yl)-4-[[5-[1-(2-hydroxy-2-methylpropyl)-4-methylindazol-5-yl]-2,6-naphthyridin-3-yl]amino]benzenesulfonamide
CID 172601049
N-[4,6-bis(trifluoromethyl)pyrimidin-2-yl]-4-[[5-[1-(2-hydroxy-2-methylpropyl)-4-methylindazol-5-yl]-2,6-naphthyridin-3-yl]amino]benzenesulfonamide
CID 172600464

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine?
The IUPAC name of 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine (CID 172600926) is 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine.
What is the SMILES notation for 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine?
The canonical SMILES for 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine is Cc1c(-c2nccc3cnc(Nc4ccc(S(C)(=O)=O)cc4)cc23)ccc2nn(C)cc12.
What is the InChIKey of 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine?
The InChIKey is YRNNFYLQNSOKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2S/c1-15-19(8-9-22-21(15)14-29(2)28-22)24-20-12-23(26-13-16(20)10-11-25-24)27-17-4-6-18(7-5-17)32(3,30)31/h4-14H,1-3H3,(H,26,27).
What are the key properties of 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine?
5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine has a molecular weight of 443.53 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethylindazol-5-yl)-N-(4-methylsulfonylphenyl)-2,6-naphthyridin-3-amine is sourced from PubChem (CID 172600926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).