2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol

C22H19NO — CID 139659856

IUPAC2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol
SMILESCc1cc2cc(O)ccc2n1Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19NO/c1-16-13-20-14-21(24)11-12-22(20)23(16)15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,24H,15H2,1H3
InChIKeyDMAUXYCHRQNYJM-UHFFFAOYSA-N
MW313.40 g/mol
LogP5.37
Rot. Bonds3

About 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol

2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol (PubChem CID 139659856) has the molecular formula C22H19NO and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol.

Molecular Properties

Compound Name2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol
PubChem CID139659856
Molecular FormulaC22H19NO
Molecular Weight313.40 g/mol
Exact Mass313.15
IUPAC Name2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol
SMILESCc1cc2cc(O)ccc2n1Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19NO/c1-16-13-20-14-21(24)11-12-22(20)23(16)15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,24H,15H2,1H3
InChIKeyDMAUXYCHRQNYJM-UHFFFAOYSA-N
XLogP5.37
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.40
LogP ≤ 55.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3,4-dichlorophenyl)methyl]-2-methylindol-5-ol
CID 174670552
1-ethyl-2-methylindol-5-ol
CID 115014527
2-[4-[[5-[(3-hydroxyphenyl)methylcarbamoyl]-2-methylindol-1-yl]methyl]phenyl]benzoic acid
CID 171467854
1-[(4-fluorophenyl)methyl]-2-methylindole
CID 3272016
1-[(3,4-dichlorophenyl)methyl]-2-methylindole
CID 63812577
[1-[(4-chlorophenyl)methyl]-2-methylindol-5-yl]methyl acetate
CID 67984684
1-benzyl-6-chloro-2-methylindole
CID 121404424
6-hydroxy-1-methyl-3-phenylquinolin-2-one
CID 126596648
5-fluoro-1-[(4-methoxyphenyl)methyl]-2-methylindole
CID 174227358
1-[(4-chlorophenyl)methyl]-N,2-dimethylindol-5-amine
CID 141347657
4-[(5-methoxy-2-methylindol-1-yl)methyl]aniline
CID 19779449
2-bromo-5-methyl-1-[(4-phenylphenyl)methyl]imidazole-4-carboxylic acid
CID 142503494

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol?
The IUPAC name of 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol (CID 139659856) is 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol.
What is the SMILES notation for 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol?
The canonical SMILES for 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol is Cc1cc2cc(O)ccc2n1Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol?
The InChIKey is DMAUXYCHRQNYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO/c1-16-13-20-14-21(24)11-12-22(20)23(16)15-17-7-9-19(10-8-17)18-5-3-2-4-6-18/h2-14,24H,15H2,1H3.
What are the key properties of 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol?
2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol has a molecular weight of 313.40 g/mol, XLogP of 5.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(4-phenylphenyl)methyl]indol-5-ol is sourced from PubChem (CID 139659856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).