6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile

C18H10FN9 — CID 168758967

IUPAC6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile
SMILESN#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)nc(N)c4nnnn34)cn12
InChIInChI=1S/C18H10FN9/c19-12-4-1-10(2-5-12)15-16(28-18(17(21)23-15)24-25-26-28)11-3-6-14-22-8-13(7-20)27(14)9-11/h1-6,8-9H,(H2,21,23)
InChIKeyFJNOFRLDKNVTFU-UHFFFAOYSA-N
MW371.34 g/mol
LogP2.09
Rot. Bonds2

About 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile

6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile (PubChem CID 168758967) has the molecular formula C18H10FN9 and a molecular weight of 371.34 g/mol. Its IUPAC name is 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile
PubChem CID168758967
Molecular FormulaC18H10FN9
Molecular Weight371.34 g/mol
Exact Mass371.10
IUPAC Name6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile
SMILESN#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)nc(N)c4nnnn34)cn12
InChIInChI=1S/C18H10FN9/c19-12-4-1-10(2-5-12)15-16(28-18(17(21)23-15)24-25-26-28)11-3-6-14-22-8-13(7-20)27(14)9-11/h1-6,8-9H,(H2,21,23)
InChIKeyFJNOFRLDKNVTFU-UHFFFAOYSA-N
XLogP2.09
TPSA123.08 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.34
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The IUPAC name of 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile (CID 168758967) is 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile is N#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)nc(N)c4nnnn34)cn12.
What is the InChIKey of 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The InChIKey is FJNOFRLDKNVTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10FN9/c19-12-4-1-10(2-5-12)15-16(28-18(17(21)23-15)24-25-26-28)11-3-6-14-22-8-13(7-20)27(14)9-11/h1-6,8-9H,(H2,21,23).
What are the key properties of 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile has a molecular weight of 371.34 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[8-amino-6-(4-fluorophenyl)tetrazolo[1,5-a]pyrazin-5-yl]imidazo[1,2-a]pyridine-3-carbonitrile is sourced from PubChem (CID 168758967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).