7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine

C16H14N6 — CID 90106116

IUPAC7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCCn1cc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1
InChIInChI=1S/C16H14N6/c1-2-22-10-12(7-20-22)13-8-18-16-15(13)21-14(9-19-16)11-3-5-17-6-4-11/h3-10H,2H2,1H3,(H,18,19)
InChIKeyPEACEAFJUDWKDN-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.90
Rot. Bonds3

About 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine

7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine (PubChem CID 90106116) has the molecular formula C16H14N6 and a molecular weight of 290.33 g/mol. Its IUPAC name is 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine.

Molecular Properties

Compound Name7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
PubChem CID90106116
Molecular FormulaC16H14N6
Molecular Weight290.33 g/mol
Exact Mass290.13
IUPAC Name7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine
SMILESCCn1cc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1
InChIInChI=1S/C16H14N6/c1-2-22-10-12(7-20-22)13-8-18-16-15(13)21-14(9-19-16)11-3-5-17-6-4-11/h3-10H,2H2,1H3,(H,18,19)
InChIKeyPEACEAFJUDWKDN-UHFFFAOYSA-N
XLogP2.90
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The IUPAC name of 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine (CID 90106116) is 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine.
What is the SMILES notation for 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The canonical SMILES for 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine is CCn1cc(-c2c[nH]c3ncc(-c4ccncc4)nc23)cn1.
What is the InChIKey of 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
The InChIKey is PEACEAFJUDWKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6/c1-2-22-10-12(7-20-22)13-8-18-16-15(13)21-14(9-19-16)11-3-5-17-6-4-11/h3-10H,2H2,1H3,(H,18,19).
What are the key properties of 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine?
7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine has a molecular weight of 290.33 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-ethylpyrazol-4-yl)-2-pyridin-4-yl-5H-pyrrolo[2,3-b]pyrazine is sourced from PubChem (CID 90106116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).