2,4-diphenyl-1,2-dihydropyridine

C17H15N — CID 18001057

IUPAC2,4-diphenyl-1,2-dihydropyridine
SMILESC1=CC(c2ccccc2)=CC(c2ccccc2)N1
InChIInChI=1S/C17H15N/c1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15/h1-13,17-18H
InChIKeyXISWVMFXJZQUER-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.93
Rot. Bonds2

About 2,4-diphenyl-1,2-dihydropyridine

2,4-diphenyl-1,2-dihydropyridine (PubChem CID 18001057) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 2,4-diphenyl-1,2-dihydropyridine.

Molecular Properties

Compound Name2,4-diphenyl-1,2-dihydropyridine
PubChem CID18001057
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name2,4-diphenyl-1,2-dihydropyridine
SMILESC1=CC(c2ccccc2)=CC(c2ccccc2)N1
InChIInChI=1S/C17H15N/c1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15/h1-13,17-18H
InChIKeyXISWVMFXJZQUER-UHFFFAOYSA-N
XLogP3.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-1,2-dihydropyridine?
The IUPAC name of 2,4-diphenyl-1,2-dihydropyridine (CID 18001057) is 2,4-diphenyl-1,2-dihydropyridine.
What is the SMILES notation for 2,4-diphenyl-1,2-dihydropyridine?
The canonical SMILES for 2,4-diphenyl-1,2-dihydropyridine is C1=CC(c2ccccc2)=CC(c2ccccc2)N1.
What is the InChIKey of 2,4-diphenyl-1,2-dihydropyridine?
The InChIKey is XISWVMFXJZQUER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15/h1-13,17-18H.
What are the key properties of 2,4-diphenyl-1,2-dihydropyridine?
2,4-diphenyl-1,2-dihydropyridine has a molecular weight of 233.31 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-1,2-dihydropyridine is sourced from PubChem (CID 18001057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).