1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine

C17H11ClN4 — CID 90418772

IUPAC1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine
SMILESClc1ccc(-n2c(-c3cnccn3)cc3ccncc32)cc1
InChIInChI=1S/C17H11ClN4/c18-13-1-3-14(4-2-13)22-16(15-10-20-7-8-21-15)9-12-5-6-19-11-17(12)22/h1-11H
InChIKeyDMBYEPFBOBWEJT-UHFFFAOYSA-N
MW306.76 g/mol
LogP4.14
Rot. Bonds2

About 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine

1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine (PubChem CID 90418772) has the molecular formula C17H11ClN4 and a molecular weight of 306.76 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine
PubChem CID90418772
Molecular FormulaC17H11ClN4
Molecular Weight306.76 g/mol
Exact Mass306.07
IUPAC Name1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine
SMILESClc1ccc(-n2c(-c3cnccn3)cc3ccncc32)cc1
InChIInChI=1S/C17H11ClN4/c18-13-1-3-14(4-2-13)22-16(15-10-20-7-8-21-15)9-12-5-6-19-11-17(12)22/h1-11H
InChIKeyDMBYEPFBOBWEJT-UHFFFAOYSA-N
XLogP4.14
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.76
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine?
The IUPAC name of 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine (CID 90418772) is 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine.
What is the SMILES notation for 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine?
The canonical SMILES for 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine is Clc1ccc(-n2c(-c3cnccn3)cc3ccncc32)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine?
The InChIKey is DMBYEPFBOBWEJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN4/c18-13-1-3-14(4-2-13)22-16(15-10-20-7-8-21-15)9-12-5-6-19-11-17(12)22/h1-11H.
What are the key properties of 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine?
1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine has a molecular weight of 306.76 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-pyrazin-2-ylpyrrolo[2,3-c]pyridine is sourced from PubChem (CID 90418772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).