2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine

C15H12FN3 — CID 10083602

IUPAC2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc(F)cc2)n1
InChIInChI=1S/C15H12FN3/c1-10-3-2-4-14(18-10)15-13(9-17-19-15)11-5-7-12(16)8-6-11/h2-9H,1H3,(H,17,19)
InChIKeyVJPFFCRCUZQGJL-UHFFFAOYSA-N
MW253.28 g/mol
LogP3.59
Rot. Bonds2

About 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine

2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine (PubChem CID 10083602) has the molecular formula C15H12FN3 and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine.

Molecular Properties

Compound Name2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine
PubChem CID10083602
Molecular FormulaC15H12FN3
Molecular Weight253.28 g/mol
Exact Mass253.10
IUPAC Name2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc(F)cc2)n1
InChIInChI=1S/C15H12FN3/c1-10-3-2-4-14(18-10)15-13(9-17-19-15)11-5-7-12(16)8-6-11/h2-9H,1H3,(H,17,19)
InChIKeyVJPFFCRCUZQGJL-UHFFFAOYSA-N
XLogP3.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine?
The IUPAC name of 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine (CID 10083602) is 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine.
What is the SMILES notation for 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine?
The canonical SMILES for 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine is Cc1cccc(-c2[nH]ncc2-c2ccc(F)cc2)n1.
What is the InChIKey of 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine?
The InChIKey is VJPFFCRCUZQGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3/c1-10-3-2-4-14(18-10)15-13(9-17-19-15)11-5-7-12(16)8-6-11/h2-9H,1H3,(H,17,19).
What are the key properties of 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine?
2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine has a molecular weight of 253.28 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorophenyl)-1H-pyrazol-5-yl]-6-methylpyridine is sourced from PubChem (CID 10083602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).