2-[9-(4-methylphenyl)carbazol-2-yl]phenol

C25H19NO — CID 118682159

IUPAC2-[9-(4-methylphenyl)carbazol-2-yl]phenol
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4ccccc4O)cc32)cc1
InChIInChI=1S/C25H19NO/c1-17-10-13-19(14-11-17)26-23-8-4-2-7-21(23)22-15-12-18(16-24(22)26)20-6-3-5-9-25(20)27/h2-16,27H,1H3
InChIKeyQIZLZDRNXWDUMP-UHFFFAOYSA-N
MW349.43 g/mol
LogP6.46
Rot. Bonds2

About 2-[9-(4-methylphenyl)carbazol-2-yl]phenol

2-[9-(4-methylphenyl)carbazol-2-yl]phenol (PubChem CID 118682159) has the molecular formula C25H19NO and a molecular weight of 349.43 g/mol. Its IUPAC name is 2-[9-(4-methylphenyl)carbazol-2-yl]phenol.

Molecular Properties

Compound Name2-[9-(4-methylphenyl)carbazol-2-yl]phenol
PubChem CID118682159
Molecular FormulaC25H19NO
Molecular Weight349.43 g/mol
Exact Mass349.15
IUPAC Name2-[9-(4-methylphenyl)carbazol-2-yl]phenol
SMILESCc1ccc(-n2c3ccccc3c3ccc(-c4ccccc4O)cc32)cc1
InChIInChI=1S/C25H19NO/c1-17-10-13-19(14-11-17)26-23-8-4-2-7-21(23)22-15-12-18(16-24(22)26)20-6-3-5-9-25(20)27/h2-16,27H,1H3
InChIKeyQIZLZDRNXWDUMP-UHFFFAOYSA-N
XLogP6.46
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.43
LogP ≤ 56.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[9-(4-methylphenyl)carbazol-2-yl]phenol?
The IUPAC name of 2-[9-(4-methylphenyl)carbazol-2-yl]phenol (CID 118682159) is 2-[9-(4-methylphenyl)carbazol-2-yl]phenol.
What is the SMILES notation for 2-[9-(4-methylphenyl)carbazol-2-yl]phenol?
The canonical SMILES for 2-[9-(4-methylphenyl)carbazol-2-yl]phenol is Cc1ccc(-n2c3ccccc3c3ccc(-c4ccccc4O)cc32)cc1.
What is the InChIKey of 2-[9-(4-methylphenyl)carbazol-2-yl]phenol?
The InChIKey is QIZLZDRNXWDUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19NO/c1-17-10-13-19(14-11-17)26-23-8-4-2-7-21(23)22-15-12-18(16-24(22)26)20-6-3-5-9-25(20)27/h2-16,27H,1H3.
What are the key properties of 2-[9-(4-methylphenyl)carbazol-2-yl]phenol?
2-[9-(4-methylphenyl)carbazol-2-yl]phenol has a molecular weight of 349.43 g/mol, XLogP of 6.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-(4-methylphenyl)carbazol-2-yl]phenol is sourced from PubChem (CID 118682159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).