4-(2-nitrophenyl)-2-phenylpyridine

C17H12N2O2 — CID 102105042

IUPAC4-(2-nitrophenyl)-2-phenylpyridine
SMILESO=[N+]([O-])c1ccccc1-c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C17H12N2O2/c20-19(21)17-9-5-4-8-15(17)14-10-11-18-16(12-14)13-6-2-1-3-7-13/h1-12H
InChIKeyALJZMFIVLWNTAZ-UHFFFAOYSA-N
MW276.30 g/mol
LogP4.32
Rot. Bonds3

About 4-(2-nitrophenyl)-2-phenylpyridine

4-(2-nitrophenyl)-2-phenylpyridine (PubChem CID 102105042) has the molecular formula C17H12N2O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is 4-(2-nitrophenyl)-2-phenylpyridine.

Molecular Properties

Compound Name4-(2-nitrophenyl)-2-phenylpyridine
PubChem CID102105042
Molecular FormulaC17H12N2O2
Molecular Weight276.30 g/mol
Exact Mass276.09
IUPAC Name4-(2-nitrophenyl)-2-phenylpyridine
SMILESO=[N+]([O-])c1ccccc1-c1ccnc(-c2ccccc2)c1
InChIInChI=1S/C17H12N2O2/c20-19(21)17-9-5-4-8-15(17)14-10-11-18-16(12-14)13-6-2-1-3-7-13/h1-12H
InChIKeyALJZMFIVLWNTAZ-UHFFFAOYSA-N
XLogP4.32
TPSA56.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-nitrophenyl)-2-phenylpyridine?
The IUPAC name of 4-(2-nitrophenyl)-2-phenylpyridine (CID 102105042) is 4-(2-nitrophenyl)-2-phenylpyridine.
What is the SMILES notation for 4-(2-nitrophenyl)-2-phenylpyridine?
The canonical SMILES for 4-(2-nitrophenyl)-2-phenylpyridine is O=[N+]([O-])c1ccccc1-c1ccnc(-c2ccccc2)c1.
What is the InChIKey of 4-(2-nitrophenyl)-2-phenylpyridine?
The InChIKey is ALJZMFIVLWNTAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O2/c20-19(21)17-9-5-4-8-15(17)14-10-11-18-16(12-14)13-6-2-1-3-7-13/h1-12H.
What are the key properties of 4-(2-nitrophenyl)-2-phenylpyridine?
4-(2-nitrophenyl)-2-phenylpyridine has a molecular weight of 276.30 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-nitrophenyl)-2-phenylpyridine is sourced from PubChem (CID 102105042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).