2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol

C28H25NO — CID 132570995

IUPAC2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol
SMILESCc1ccc(N2c3ccc(C)cc3C(O)(c3ccccc3)c3cc(C)ccc32)cc1
InChIInChI=1S/C28H25NO/c1-19-9-13-23(14-10-19)29-26-15-11-20(2)17-24(26)28(30,22-7-5-4-6-8-22)25-18-21(3)12-16-27(25)29/h4-18,30H,1-3H3
InChIKeyRLYGKWIQRORCSU-UHFFFAOYSA-N
MW391.51 g/mol
LogP6.68
Rot. Bonds2

About 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol

2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol (PubChem CID 132570995) has the molecular formula C28H25NO and a molecular weight of 391.51 g/mol. Its IUPAC name is 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol.

Molecular Properties

Compound Name2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol
PubChem CID132570995
Molecular FormulaC28H25NO
Molecular Weight391.51 g/mol
Exact Mass391.19
IUPAC Name2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol
SMILESCc1ccc(N2c3ccc(C)cc3C(O)(c3ccccc3)c3cc(C)ccc32)cc1
InChIInChI=1S/C28H25NO/c1-19-9-13-23(14-10-19)29-26-15-11-20(2)17-24(26)28(30,22-7-5-4-6-8-22)25-18-21(3)12-16-27(25)29/h4-18,30H,1-3H3
InChIKeyRLYGKWIQRORCSU-UHFFFAOYSA-N
XLogP6.68
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.51
LogP ≤ 56.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol?
The IUPAC name of 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol (CID 132570995) is 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol.
What is the SMILES notation for 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol?
The canonical SMILES for 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol is Cc1ccc(N2c3ccc(C)cc3C(O)(c3ccccc3)c3cc(C)ccc32)cc1.
What is the InChIKey of 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol?
The InChIKey is RLYGKWIQRORCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NO/c1-19-9-13-23(14-10-19)29-26-15-11-20(2)17-24(26)28(30,22-7-5-4-6-8-22)25-18-21(3)12-16-27(25)29/h4-18,30H,1-3H3.
What are the key properties of 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol?
2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol has a molecular weight of 391.51 g/mol, XLogP of 6.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-10-(4-methylphenyl)-9-phenylacridin-9-ol is sourced from PubChem (CID 132570995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).