N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine

C24H19N7S — CID 137014603

IUPACN,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
SMILESCN(C)c1cncc(-c2ccc3[nH]nc(-c4nc5nccc(-c6cccs6)c5[nH]4)c3c2)c1
InChIInChI=1S/C24H19N7S/c1-31(2)16-10-15(12-25-13-16)14-5-6-19-18(11-14)22(30-29-19)24-27-21-17(20-4-3-9-32-20)7-8-26-23(21)28-24/h3-13H,1-2H3,(H,29,30)(H,26,27,28)
InChIKeyPQSGSOQAKMPPSX-UHFFFAOYSA-N
MW437.53 g/mol
LogP5.36
Rot. Bonds4

About N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine

N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine (PubChem CID 137014603) has the molecular formula C24H19N7S and a molecular weight of 437.53 g/mol. Its IUPAC name is N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
PubChem CID137014603
Molecular FormulaC24H19N7S
Molecular Weight437.53 g/mol
Exact Mass437.14
IUPAC NameN,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
SMILESCN(C)c1cncc(-c2ccc3[nH]nc(-c4nc5nccc(-c6cccs6)c5[nH]4)c3c2)c1
InChIInChI=1S/C24H19N7S/c1-31(2)16-10-15(12-25-13-16)14-5-6-19-18(11-14)22(30-29-19)24-27-21-17(20-4-3-9-32-20)7-8-26-23(21)28-24/h3-13H,1-2H3,(H,29,30)(H,26,27,28)
InChIKeyPQSGSOQAKMPPSX-UHFFFAOYSA-N
XLogP5.36
TPSA86.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.53
LogP ≤ 55.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine with MolForge

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Related Compounds

5-[3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]-N,N-dimethylpyridin-3-amine
CID 137133900
2-[5-(5-methoxy-3-pyridinyl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-7-thiophen-2-yl-1H-imidazo[4,5-b]pyridine
CID 136937565
2-cyclohexyl-N-[5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]acetamide
CID 136937955
7-pyridin-4-yl-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridine
CID 136937796
2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-2-yl-1H-imidazo[4,5-b]pyridine
CID 137042503
2-(5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-2-yl-1H-imidazo[4,5-b]pyridine
CID 137042191
N-propan-2-yl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine
CID 137042293
N,N-dimethyl-5-[3-[7-(5-methylthiophen-2-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine
CID 137042113
5-[3-[7-(5-fluorothiophen-2-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-pyrazolo[3,4-c]pyridin-5-yl]-N,N-dimethylpyridin-3-amine
CID 137055695
7-pyridin-2-yl-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridine
CID 136937783
5-[6-fluoro-3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]-N,N-dimethylpyridin-3-amine
CID 137134692
1-[5-[2-[5-[5-(dimethylamino)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridin-3-yl]-1H-imidazo[4,5-b]pyridin-7-yl]thiophen-2-yl]ethanone
CID 137055736

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The IUPAC name of N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine (CID 137014603) is N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine.
What is the SMILES notation for N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The canonical SMILES for N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine is CN(C)c1cncc(-c2ccc3[nH]nc(-c4nc5nccc(-c6cccs6)c5[nH]4)c3c2)c1.
What is the InChIKey of N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The InChIKey is PQSGSOQAKMPPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N7S/c1-31(2)16-10-15(12-25-13-16)14-5-6-19-18(11-14)22(30-29-19)24-27-21-17(20-4-3-9-32-20)7-8-26-23(21)28-24/h3-13H,1-2H3,(H,29,30)(H,26,27,28).
What are the key properties of N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine has a molecular weight of 437.53 g/mol, XLogP of 5.36, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[3-(7-thiophen-2-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine is sourced from PubChem (CID 137014603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).