4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine

C22H19N7O — CID 137135670

IUPAC4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine
SMILESc1cncc(-c2ccc3[nH]nc(-c4nc5nccc(N6CCOCC6)c5[nH]4)c3c2)c1
InChIInChI=1S/C22H19N7O/c1-2-15(13-23-6-1)14-3-4-17-16(12-14)19(28-27-17)22-25-20-18(5-7-24-21(20)26-22)29-8-10-30-11-9-29/h1-7,12-13H,8-11H2,(H,27,28)(H,24,25,26)
InChIKeyLJLULMSXFUVCMK-UHFFFAOYSA-N
MW397.44 g/mol
LogP3.40
Rot. Bonds3

About 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine

4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine (PubChem CID 137135670) has the molecular formula C22H19N7O and a molecular weight of 397.44 g/mol. Its IUPAC name is 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine.

Molecular Properties

Compound Name4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine
PubChem CID137135670
Molecular FormulaC22H19N7O
Molecular Weight397.44 g/mol
Exact Mass397.17
IUPAC Name4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine
SMILESc1cncc(-c2ccc3[nH]nc(-c4nc5nccc(N6CCOCC6)c5[nH]4)c3c2)c1
InChIInChI=1S/C22H19N7O/c1-2-15(13-23-6-1)14-3-4-17-16(12-14)19(28-27-17)22-25-20-18(5-7-24-21(20)26-22)29-8-10-30-11-9-29/h1-7,12-13H,8-11H2,(H,27,28)(H,24,25,26)
InChIKeyLJLULMSXFUVCMK-UHFFFAOYSA-N
XLogP3.40
TPSA95.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.44
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(5-methoxy-3-pyridinyl)-1H-indazol-3-yl]-7-piperidin-1-yl-1H-imidazo[4,5-b]pyridine
CID 136938039
4-[2-[5-(1-cyclopropylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-1H-imidazo[4,5-b]pyridin-7-yl]morpholine
CID 136937550
N-[5-[3-(7-piperidin-1-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]benzamide
CID 137134001
4-pyridin-3-yl-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
CID 137019318
2-[5-(2,3-dimethylimidazol-4-yl)-1H-indazol-3-yl]-7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridine
CID 136937844
7-piperidin-1-yl-2-[5-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-b]pyridine
CID 136938051
N-[5-[3-[7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]butanamide
CID 137134048
2-(7-fluoro-5-pyridin-3-yl-2H-indazol-3-yl)-7-piperidin-1-yl-1H-imidazo[4,5-b]pyridine
CID 137134393
N-[5-[3-[7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]cyclopentanecarboxamide
CID 137014616
10,15-dimethyl-3,6,10,15,19,26,27,31-octazahexacyclo[20.5.2.12,5.117,21.04,9.025,28]hentriaconta-1(27),2(31),4(9),5,7,17(30),18,20,22(29),23,25(28)-undecaene
CID 153295770
N-[5-[3-(7-piperidin-1-yl-1H-imidazo[4,5-b]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]pentanamide
CID 137134013
N-[5-[3-[7-(4-methylpiperazin-1-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]pentanamide
CID 137134050

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine?
The IUPAC name of 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine (CID 137135670) is 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine.
What is the SMILES notation for 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine?
The canonical SMILES for 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine is c1cncc(-c2ccc3[nH]nc(-c4nc5nccc(N6CCOCC6)c5[nH]4)c3c2)c1.
What is the InChIKey of 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine?
The InChIKey is LJLULMSXFUVCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N7O/c1-2-15(13-23-6-1)14-3-4-17-16(12-14)19(28-27-17)22-25-20-18(5-7-24-21(20)26-22)29-8-10-30-11-9-29/h1-7,12-13H,8-11H2,(H,27,28)(H,24,25,26).
What are the key properties of 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine?
4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine has a molecular weight of 397.44 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]morpholine is sourced from PubChem (CID 137135670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).