4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine

C24H20N2 — CID 12691374

IUPAC4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine
SMILESc1ccc(C(c2ccncc2)C(c2ccccc2)c2ccncc2)cc1
InChIInChI=1S/C24H20N2/c1-3-7-19(8-4-1)23(21-11-15-25-16-12-21)24(20-9-5-2-6-10-20)22-13-17-26-18-14-22/h1-18,23-24H
InChIKeyMPTHDUITCWGWGD-UHFFFAOYSA-N
MW336.44 g/mol
LogP5.44
Rot. Bonds5

About 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine

4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine (PubChem CID 12691374) has the molecular formula C24H20N2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine.

Molecular Properties

Compound Name4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine
PubChem CID12691374
Molecular FormulaC24H20N2
Molecular Weight336.44 g/mol
Exact Mass336.16
IUPAC Name4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine
SMILESc1ccc(C(c2ccncc2)C(c2ccccc2)c2ccncc2)cc1
InChIInChI=1S/C24H20N2/c1-3-7-19(8-4-1)23(21-11-15-25-16-12-21)24(20-9-5-2-6-10-20)22-13-17-26-18-14-22/h1-18,23-24H
InChIKeyMPTHDUITCWGWGD-UHFFFAOYSA-N
XLogP5.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.44
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine?
The IUPAC name of 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine (CID 12691374) is 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine.
What is the SMILES notation for 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine?
The canonical SMILES for 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine is c1ccc(C(c2ccncc2)C(c2ccccc2)c2ccncc2)cc1.
What is the InChIKey of 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine?
The InChIKey is MPTHDUITCWGWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2/c1-3-7-19(8-4-1)23(21-11-15-25-16-12-21)24(20-9-5-2-6-10-20)22-13-17-26-18-14-22/h1-18,23-24H.
What are the key properties of 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine?
4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine has a molecular weight of 336.44 g/mol, XLogP of 5.44, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine is sourced from PubChem (CID 12691374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).