10-benzyl-9-(2-methylphenyl)acridin-9-ol

C27H23NO — CID 16748422

IUPAC10-benzyl-9-(2-methylphenyl)acridin-9-ol
SMILESCc1ccccc1C1(O)c2ccccc2N(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C27H23NO/c1-20-11-5-6-14-22(20)27(29)23-15-7-9-17-25(23)28(19-21-12-3-2-4-13-21)26-18-10-8-16-24(26)27/h2-18,29H,19H2,1H3
InChIKeyCTFNTWWYPQGFCR-UHFFFAOYSA-N
MW377.49 g/mol
LogP5.93
Rot. Bonds3

About 10-benzyl-9-(2-methylphenyl)acridin-9-ol

10-benzyl-9-(2-methylphenyl)acridin-9-ol (PubChem CID 16748422) has the molecular formula C27H23NO and a molecular weight of 377.49 g/mol. Its IUPAC name is 10-benzyl-9-(2-methylphenyl)acridin-9-ol.

Molecular Properties

Compound Name10-benzyl-9-(2-methylphenyl)acridin-9-ol
PubChem CID16748422
Molecular FormulaC27H23NO
Molecular Weight377.49 g/mol
Exact Mass377.18
IUPAC Name10-benzyl-9-(2-methylphenyl)acridin-9-ol
SMILESCc1ccccc1C1(O)c2ccccc2N(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C27H23NO/c1-20-11-5-6-14-22(20)27(29)23-15-7-9-17-25(23)28(19-21-12-3-2-4-13-21)26-18-10-8-16-24(26)27/h2-18,29H,19H2,1H3
InChIKeyCTFNTWWYPQGFCR-UHFFFAOYSA-N
XLogP5.93
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.49
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzyl-3,3-dimethylindole-2-thione
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1-benzyl-3-hydroxy-3-[2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl]indol-2-one
CID 2957228
(3S)-1-benzyl-3-hydroxy-3-[(2R)-2-hydroxypropyl]indol-2-one
CID 9177438
9,9-dimethyl-10-[(2-methylphenyl)methyl]acridine
CID 123972048
1-benzyl-3,3-bis(4-hydroxy-3-methylphenyl)indol-2-one
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1-benzyl-3-(2-bromoethyl)-3-methylindol-2-one
CID 166448944
(3R)-1-benzyl-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]indol-2-one
CID 7357344
(3S)-1-benzyl-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]indol-2-one
CID 7357342
ethyl 3-(1-benzyl-3-methyl-2-oxoindol-3-yl)propanoate
CID 122370886
(3R)-1-benzyl-3-[2-(2,4-dimethylfuran-3-yl)-2-oxoethyl]-3-hydroxyindol-2-one
CID 1295142
(3S)-1-[(3-fluorophenyl)methyl]-3-hydroxy-3-phenylindol-2-one
CID 95095514
1-benzyl-4-hydroxy-3-methoxy-4-phenyl-3H-quinolin-2-one
CID 142438041

Frequently Asked Questions

What is the IUPAC name of 10-benzyl-9-(2-methylphenyl)acridin-9-ol?
The IUPAC name of 10-benzyl-9-(2-methylphenyl)acridin-9-ol (CID 16748422) is 10-benzyl-9-(2-methylphenyl)acridin-9-ol.
What is the SMILES notation for 10-benzyl-9-(2-methylphenyl)acridin-9-ol?
The canonical SMILES for 10-benzyl-9-(2-methylphenyl)acridin-9-ol is Cc1ccccc1C1(O)c2ccccc2N(Cc2ccccc2)c2ccccc21.
What is the InChIKey of 10-benzyl-9-(2-methylphenyl)acridin-9-ol?
The InChIKey is CTFNTWWYPQGFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23NO/c1-20-11-5-6-14-22(20)27(29)23-15-7-9-17-25(23)28(19-21-12-3-2-4-13-21)26-18-10-8-16-24(26)27/h2-18,29H,19H2,1H3.
What are the key properties of 10-benzyl-9-(2-methylphenyl)acridin-9-ol?
10-benzyl-9-(2-methylphenyl)acridin-9-ol has a molecular weight of 377.49 g/mol, XLogP of 5.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-benzyl-9-(2-methylphenyl)acridin-9-ol is sourced from PubChem (CID 16748422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).