9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine

C33H27N — CID 71004140

IUPAC9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine
SMILESCCC1(c2ccccc2)c2ccccc2N(c2ccc(-c3ccccc3)cc2)c2ccccc21
InChIInChI=1S/C33H27N/c1-2-33(27-15-7-4-8-16-27)29-17-9-11-19-31(29)34(32-20-12-10-18-30(32)33)28-23-21-26(22-24-28)25-13-5-3-6-14-25/h3-24H,2H2,1H3
InChIKeyRCIZESDWWMEBJK-UHFFFAOYSA-N
MW437.59 g/mol
LogP8.88
Rot. Bonds4

About 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine

9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine (PubChem CID 71004140) has the molecular formula C33H27N and a molecular weight of 437.59 g/mol. Its IUPAC name is 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine.

Molecular Properties

Compound Name9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine
PubChem CID71004140
Molecular FormulaC33H27N
Molecular Weight437.59 g/mol
Exact Mass437.21
IUPAC Name9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine
SMILESCCC1(c2ccccc2)c2ccccc2N(c2ccc(-c3ccccc3)cc2)c2ccccc21
InChIInChI=1S/C33H27N/c1-2-33(27-15-7-4-8-16-27)29-17-9-11-19-31(29)34(32-20-12-10-18-30(32)33)28-23-21-26(22-24-28)25-13-5-3-6-14-25/h3-24H,2H2,1H3
InChIKeyRCIZESDWWMEBJK-UHFFFAOYSA-N
XLogP8.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.59
LogP ≤ 58.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine?
The IUPAC name of 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine (CID 71004140) is 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine.
What is the SMILES notation for 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine?
The canonical SMILES for 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine is CCC1(c2ccccc2)c2ccccc2N(c2ccc(-c3ccccc3)cc2)c2ccccc21.
What is the InChIKey of 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine?
The InChIKey is RCIZESDWWMEBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27N/c1-2-33(27-15-7-4-8-16-27)29-17-9-11-19-31(29)34(32-20-12-10-18-30(32)33)28-23-21-26(22-24-28)25-13-5-3-6-14-25/h3-24H,2H2,1H3.
What are the key properties of 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine?
9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine has a molecular weight of 437.59 g/mol, XLogP of 8.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-9-phenyl-10-(4-phenylphenyl)acridine is sourced from PubChem (CID 71004140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).