4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine

C18H13N3 — CID 53469858

IUPAC4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine
SMILESc1ccc2cc(-c3[nH]ncc3-c3ccncc3)ccc2c1
InChIInChI=1S/C18H13N3/c1-2-4-15-11-16(6-5-13(15)3-1)18-17(12-20-21-18)14-7-9-19-10-8-14/h1-12H,(H,20,21)
InChIKeyGLFSGNWAZDGYBV-UHFFFAOYSA-N
MW271.32 g/mol
LogP4.29
Rot. Bonds2

About 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine

4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine (PubChem CID 53469858) has the molecular formula C18H13N3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine.

Molecular Properties

Compound Name4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine
PubChem CID53469858
Molecular FormulaC18H13N3
Molecular Weight271.32 g/mol
Exact Mass271.11
IUPAC Name4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine
SMILESc1ccc2cc(-c3[nH]ncc3-c3ccncc3)ccc2c1
InChIInChI=1S/C18H13N3/c1-2-4-15-11-16(6-5-13(15)3-1)18-17(12-20-21-18)14-7-9-19-10-8-14/h1-12H,(H,20,21)
InChIKeyGLFSGNWAZDGYBV-UHFFFAOYSA-N
XLogP4.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine?
The IUPAC name of 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine (CID 53469858) is 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine.
What is the SMILES notation for 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine?
The canonical SMILES for 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine is c1ccc2cc(-c3[nH]ncc3-c3ccncc3)ccc2c1.
What is the InChIKey of 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine?
The InChIKey is GLFSGNWAZDGYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3/c1-2-4-15-11-16(6-5-13(15)3-1)18-17(12-20-21-18)14-7-9-19-10-8-14/h1-12H,(H,20,21).
What are the key properties of 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine?
4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine has a molecular weight of 271.32 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-naphthalen-2-yl-1H-pyrazol-4-yl)pyridine is sourced from PubChem (CID 53469858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).