3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine

C18H19N3O — CID 167942755

IUPAC3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
SMILESCC(C)Oc1cncc(-c2ccnc3[nH]cc(C4CC4)c23)c1
InChIInChI=1S/C18H19N3O/c1-11(2)22-14-7-13(8-19-9-14)15-5-6-20-18-17(15)16(10-21-18)12-3-4-12/h5-12H,3-4H2,1-2H3,(H,20,21)
InChIKeyOFBWGLBTLFEQMG-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.29
Rot. Bonds4

About 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine

3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 167942755) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID167942755
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine
SMILESCC(C)Oc1cncc(-c2ccnc3[nH]cc(C4CC4)c23)c1
InChIInChI=1S/C18H19N3O/c1-11(2)22-14-7-13(8-19-9-14)15-5-6-20-18-17(15)16(10-21-18)12-3-4-12/h5-12H,3-4H2,1-2H3,(H,20,21)
InChIKeyOFBWGLBTLFEQMG-UHFFFAOYSA-N
XLogP4.29
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine (CID 167942755) is 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine is CC(C)Oc1cncc(-c2ccnc3[nH]cc(C4CC4)c23)c1.
What is the InChIKey of 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is OFBWGLBTLFEQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-11(2)22-14-7-13(8-19-9-14)15-5-6-20-18-17(15)16(10-21-18)12-3-4-12/h5-12H,3-4H2,1-2H3,(H,20,21).
What are the key properties of 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine?
3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 293.37 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-4-(5-propan-2-yloxy-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 167942755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).