7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine

C17H13N5O — CID 90105551

IUPAC7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCOc1ccc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1
InChIInChI=1S/C17H13N5O/c1-23-15-3-2-12(8-19-15)13-9-20-17-16(13)22-14(10-21-17)11-4-6-18-7-5-11/h2-10H,1H3,(H,20,21)
InChIKeyMFBISPJAJVLRFK-UHFFFAOYSA-N
MW303.33 g/mol
LogP3.09
Rot. Bonds3

About 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine

7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 90105551) has the molecular formula C17H13N5O and a molecular weight of 303.33 g/mol. Its IUPAC name is 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
PubChem CID90105551
Molecular FormulaC17H13N5O
Molecular Weight303.33 g/mol
Exact Mass303.11
IUPAC Name7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCOc1ccc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1
InChIInChI=1S/C17H13N5O/c1-23-15-3-2-12(8-19-15)13-9-20-17-16(13)22-14(10-21-17)11-4-6-18-7-5-11/h2-10H,1H3,(H,20,21)
InChIKeyMFBISPJAJVLRFK-UHFFFAOYSA-N
XLogP3.09
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine (CID 90105551) is 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine is COc1ccc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1.
What is the InChIKey of 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is MFBISPJAJVLRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O/c1-23-15-3-2-12(8-19-15)13-9-20-17-16(13)22-14(10-21-17)11-4-6-18-7-5-11/h2-10H,1H3,(H,20,21).
What are the key properties of 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 303.33 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-methoxy-3-pyridinyl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 90105551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).