4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine

C17H15N5 — CID 151444691

IUPAC4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCn1cc(-c2ccnc3[nH]ccc23)c(-c2ccncc2)n1
InChIInChI=1S/C17H15N5/c1-2-22-11-15(16(21-22)12-3-7-18-8-4-12)13-5-9-19-17-14(13)6-10-20-17/h3-11H,2H2,1H3,(H,19,20)
InChIKeyPFGDMWRJZJWCBZ-UHFFFAOYSA-N
MW289.34 g/mol
LogP3.51
Rot. Bonds3

About 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine

4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 151444691) has the molecular formula C17H15N5 and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID151444691
Molecular FormulaC17H15N5
Molecular Weight289.34 g/mol
Exact Mass289.13
IUPAC Name4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESCCn1cc(-c2ccnc3[nH]ccc23)c(-c2ccncc2)n1
InChIInChI=1S/C17H15N5/c1-2-22-11-15(16(21-22)12-3-7-18-8-4-12)13-5-9-19-17-14(13)6-10-20-17/h3-11H,2H2,1H3,(H,19,20)
InChIKeyPFGDMWRJZJWCBZ-UHFFFAOYSA-N
XLogP3.51
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine (CID 151444691) is 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine is CCn1cc(-c2ccnc3[nH]ccc23)c(-c2ccncc2)n1.
What is the InChIKey of 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is PFGDMWRJZJWCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5/c1-2-22-11-15(16(21-22)12-3-7-18-8-4-12)13-5-9-19-17-14(13)6-10-20-17/h3-11H,2H2,1H3,(H,19,20).
What are the key properties of 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine?
4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 289.34 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 151444691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).