(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine

C15H11FN6 — CID 135726819

IUPAC(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1[C@H]1C=C(c2cccnc2)Nc2nnnn21
InChIInChI=1S/C15H11FN6/c16-12-6-2-1-5-11(12)14-8-13(10-4-3-7-17-9-10)18-15-19-20-21-22(14)15/h1-9,14H,(H,18,19,21)/t14-/m1/s1
InChIKeySGIMYJUZBIPLCF-CQSZACIVSA-N
MW294.29 g/mol
LogP2.26
Rot. Bonds2

About (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine

(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine (PubChem CID 135726819) has the molecular formula C15H11FN6 and a molecular weight of 294.29 g/mol. Its IUPAC name is (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine
PubChem CID135726819
Molecular FormulaC15H11FN6
Molecular Weight294.29 g/mol
Exact Mass294.10
IUPAC Name(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine
SMILESFc1ccccc1[C@H]1C=C(c2cccnc2)Nc2nnnn21
InChIInChI=1S/C15H11FN6/c16-12-6-2-1-5-11(12)14-8-13(10-4-3-7-17-9-10)18-15-19-20-21-22(14)15/h1-9,14H,(H,18,19,21)/t14-/m1/s1
InChIKeySGIMYJUZBIPLCF-CQSZACIVSA-N
XLogP2.26
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.29
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine?
The IUPAC name of (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine (CID 135726819) is (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine.
What is the SMILES notation for (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine?
The canonical SMILES for (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine is Fc1ccccc1[C@H]1C=C(c2cccnc2)Nc2nnnn21.
What is the InChIKey of (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine?
The InChIKey is SGIMYJUZBIPLCF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H11FN6/c16-12-6-2-1-5-11(12)14-8-13(10-4-3-7-17-9-10)18-15-19-20-21-22(14)15/h1-9,14H,(H,18,19,21)/t14-/m1/s1.
What are the key properties of (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine?
(7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine has a molecular weight of 294.29 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-7-(2-fluorophenyl)-5-pyridin-3-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 135726819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).