2-(2-phenylphenyl)-1-propylnaphthalene

C25H22 — CID 173154100

IUPAC2-(2-phenylphenyl)-1-propylnaphthalene
SMILESCCCc1c(-c2ccccc2-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C25H22/c1-2-10-23-22-14-7-6-13-20(22)17-18-25(23)24-16-9-8-15-21(24)19-11-4-3-5-12-19/h3-9,11-18H,2,10H2,1H3
InChIKeyIHJMLWYAYJQRAA-UHFFFAOYSA-N
MW322.45 g/mol
LogP7.13
Rot. Bonds4

About 2-(2-phenylphenyl)-1-propylnaphthalene

2-(2-phenylphenyl)-1-propylnaphthalene (PubChem CID 173154100) has the molecular formula C25H22 and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-(2-phenylphenyl)-1-propylnaphthalene.

Molecular Properties

Compound Name2-(2-phenylphenyl)-1-propylnaphthalene
PubChem CID173154100
Molecular FormulaC25H22
Molecular Weight322.45 g/mol
Exact Mass322.17
IUPAC Name2-(2-phenylphenyl)-1-propylnaphthalene
SMILESCCCc1c(-c2ccccc2-c2ccccc2)ccc2ccccc12
InChIInChI=1S/C25H22/c1-2-10-23-22-14-7-6-13-20(22)17-18-25(23)24-16-9-8-15-21(24)19-11-4-3-5-12-19/h3-9,11-18H,2,10H2,1H3
InChIKeyIHJMLWYAYJQRAA-UHFFFAOYSA-N
XLogP7.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.45
LogP ≤ 57.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenyl)-1-propylnaphthalene?
The IUPAC name of 2-(2-phenylphenyl)-1-propylnaphthalene (CID 173154100) is 2-(2-phenylphenyl)-1-propylnaphthalene.
What is the SMILES notation for 2-(2-phenylphenyl)-1-propylnaphthalene?
The canonical SMILES for 2-(2-phenylphenyl)-1-propylnaphthalene is CCCc1c(-c2ccccc2-c2ccccc2)ccc2ccccc12.
What is the InChIKey of 2-(2-phenylphenyl)-1-propylnaphthalene?
The InChIKey is IHJMLWYAYJQRAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22/c1-2-10-23-22-14-7-6-13-20(22)17-18-25(23)24-16-9-8-15-21(24)19-11-4-3-5-12-19/h3-9,11-18H,2,10H2,1H3.
What are the key properties of 2-(2-phenylphenyl)-1-propylnaphthalene?
2-(2-phenylphenyl)-1-propylnaphthalene has a molecular weight of 322.45 g/mol, XLogP of 7.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenyl)-1-propylnaphthalene is sourced from PubChem (CID 173154100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).