2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine

C19H18FN3 — CID 56598796

IUPAC2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine
SMILESFc1ccccc1Cn1nc(-c2ccccn2)cc1C1CCC1
InChIInChI=1S/C19H18FN3/c20-16-9-2-1-6-15(16)13-23-19(14-7-5-8-14)12-18(22-23)17-10-3-4-11-21-17/h1-4,6,9-12,14H,5,7-8,13H2
InChIKeyMUVQWBRSVHWKEH-UHFFFAOYSA-N
MW307.37 g/mol
LogP4.40
Rot. Bonds4

About 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine

2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine (PubChem CID 56598796) has the molecular formula C19H18FN3 and a molecular weight of 307.37 g/mol. Its IUPAC name is 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine.

Molecular Properties

Compound Name2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine
PubChem CID56598796
Molecular FormulaC19H18FN3
Molecular Weight307.37 g/mol
Exact Mass307.15
IUPAC Name2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine
SMILESFc1ccccc1Cn1nc(-c2ccccn2)cc1C1CCC1
InChIInChI=1S/C19H18FN3/c20-16-9-2-1-6-15(16)13-23-19(14-7-5-8-14)12-18(22-23)17-10-3-4-11-21-17/h1-4,6,9-12,14H,5,7-8,13H2
InChIKeyMUVQWBRSVHWKEH-UHFFFAOYSA-N
XLogP4.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine?
The IUPAC name of 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine (CID 56598796) is 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine.
What is the SMILES notation for 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine?
The canonical SMILES for 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine is Fc1ccccc1Cn1nc(-c2ccccn2)cc1C1CCC1.
What is the InChIKey of 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine?
The InChIKey is MUVQWBRSVHWKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3/c20-16-9-2-1-6-15(16)13-23-19(14-7-5-8-14)12-18(22-23)17-10-3-4-11-21-17/h1-4,6,9-12,14H,5,7-8,13H2.
What are the key properties of 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine?
2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine has a molecular weight of 307.37 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-cyclobutyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]pyridine is sourced from PubChem (CID 56598796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).