5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol

C19H13N5O — CID 137115267

IUPAC5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol
SMILESOc1cncc(-c2ccc3[nH]nc(-c4cc5ncccc5[nH]4)c3c2)c1
InChIInChI=1S/C19H13N5O/c25-13-6-12(9-20-10-13)11-3-4-15-14(7-11)19(24-23-15)18-8-17-16(22-18)2-1-5-21-17/h1-10,22,25H,(H,23,24)
InChIKeySOIHZKYOXBXDMO-UHFFFAOYSA-N
MW327.35 g/mol
LogP3.87
Rot. Bonds2

About 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol

5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol (PubChem CID 137115267) has the molecular formula C19H13N5O and a molecular weight of 327.35 g/mol. Its IUPAC name is 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol.

Molecular Properties

Compound Name5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol
PubChem CID137115267
Molecular FormulaC19H13N5O
Molecular Weight327.35 g/mol
Exact Mass327.11
IUPAC Name5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol
SMILESOc1cncc(-c2ccc3[nH]nc(-c4cc5ncccc5[nH]4)c3c2)c1
InChIInChI=1S/C19H13N5O/c25-13-6-12(9-20-10-13)11-3-4-15-14(7-11)19(24-23-15)18-8-17-16(22-18)2-1-5-21-17/h1-10,22,25H,(H,23,24)
InChIKeySOIHZKYOXBXDMO-UHFFFAOYSA-N
XLogP3.87
TPSA90.48 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.35
LogP ≤ 53.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol?
The IUPAC name of 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol (CID 137115267) is 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol.
What is the SMILES notation for 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol?
The canonical SMILES for 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol is Oc1cncc(-c2ccc3[nH]nc(-c4cc5ncccc5[nH]4)c3c2)c1.
What is the InChIKey of 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol?
The InChIKey is SOIHZKYOXBXDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N5O/c25-13-6-12(9-20-10-13)11-3-4-15-14(7-11)19(24-23-15)18-8-17-16(22-18)2-1-5-21-17/h1-10,22,25H,(H,23,24).
What are the key properties of 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol?
5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol has a molecular weight of 327.35 g/mol, XLogP of 3.87, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(1H-pyrrolo[3,2-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-ol is sourced from PubChem (CID 137115267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).