7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine

C17H11FN4 — CID 11098241

IUPAC7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine
SMILESFc1ccc(-c2c(-c3ccncc3)[nH]c3cncnc23)cc1
InChIInChI=1S/C17H11FN4/c18-13-3-1-11(2-4-13)15-16(12-5-7-19-8-6-12)22-14-9-20-10-21-17(14)15/h1-10,22H
InChIKeyVTZDALBSCZLACJ-UHFFFAOYSA-N
MW290.30 g/mol
LogP3.83
Rot. Bonds2

About 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine

7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine (PubChem CID 11098241) has the molecular formula C17H11FN4 and a molecular weight of 290.30 g/mol. Its IUPAC name is 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine
PubChem CID11098241
Molecular FormulaC17H11FN4
Molecular Weight290.30 g/mol
Exact Mass290.10
IUPAC Name7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine
SMILESFc1ccc(-c2c(-c3ccncc3)[nH]c3cncnc23)cc1
InChIInChI=1S/C17H11FN4/c18-13-3-1-11(2-4-13)15-16(12-5-7-19-8-6-12)22-14-9-20-10-21-17(14)15/h1-10,22H
InChIKeyVTZDALBSCZLACJ-UHFFFAOYSA-N
XLogP3.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.30
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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PF-4708671
CID 51371303

Frequently Asked Questions

What is the IUPAC name of 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine?
The IUPAC name of 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine (CID 11098241) is 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine.
What is the SMILES notation for 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine?
The canonical SMILES for 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine is Fc1ccc(-c2c(-c3ccncc3)[nH]c3cncnc23)cc1.
What is the InChIKey of 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine?
The InChIKey is VTZDALBSCZLACJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN4/c18-13-3-1-11(2-4-13)15-16(12-5-7-19-8-6-12)22-14-9-20-10-21-17(14)15/h1-10,22H.
What are the key properties of 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine?
7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine has a molecular weight of 290.30 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluorophenyl)-6-pyridin-4-yl-5H-pyrrolo[3,2-d]pyrimidine is sourced from PubChem (CID 11098241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).