4-[(9-ethenylcarbazol-3-yl)amino]phenol

C20H16N2O — CID 56994296

IUPAC4-[(9-ethenylcarbazol-3-yl)amino]phenol
SMILESC=Cn1c2ccccc2c2cc(Nc3ccc(O)cc3)ccc21
InChIInChI=1S/C20H16N2O/c1-2-22-19-6-4-3-5-17(19)18-13-15(9-12-20(18)22)21-14-7-10-16(23)11-8-14/h2-13,21,23H,1H2
InChIKeyZYNKQOIKNGJSLR-UHFFFAOYSA-N
MW300.36 g/mol
LogP5.34
Rot. Bonds3

About 4-[(9-ethenylcarbazol-3-yl)amino]phenol

4-[(9-ethenylcarbazol-3-yl)amino]phenol (PubChem CID 56994296) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-[(9-ethenylcarbazol-3-yl)amino]phenol.

Molecular Properties

Compound Name4-[(9-ethenylcarbazol-3-yl)amino]phenol
PubChem CID56994296
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name4-[(9-ethenylcarbazol-3-yl)amino]phenol
SMILESC=Cn1c2ccccc2c2cc(Nc3ccc(O)cc3)ccc21
InChIInChI=1S/C20H16N2O/c1-2-22-19-6-4-3-5-17(19)18-13-15(9-12-20(18)22)21-14-7-10-16(23)11-8-14/h2-13,21,23H,1H2
InChIKeyZYNKQOIKNGJSLR-UHFFFAOYSA-N
XLogP5.34
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.36
LogP ≤ 55.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

9-ethenylcarbazole;dihydrochloride
CID 90094696
9-ethenyl-3-iodocarbazole
CID 2223606
9-phenyl-N-[4-[4-[(9-phenylcarbazol-3-yl)amino]phenyl]phenyl]carbazol-3-amine
CID 118227253
3-(9-ethenylcarbazol-3-yl)-9-phenylcarbazole
CID 118406403
4-(4-ethenylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 177116992
N-[4-[(2E,4Z)-hepta-2,4,6-trien-2-yl]phenyl]-9-naphthalen-2-ylcarbazol-3-amine
CID 129103361
3-bromo-9-phenylcarbazole;N,9-diphenylcarbazol-3-amine
CID 161460507
N-phenyl-9-(4-phenylphenyl)carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)carbazol-3-amine;9-phenyl-N-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-2-amine
CID 159366258
9-naphthalen-1-yl-N-triphenylen-2-ylcarbazol-3-amine
CID 142740278
ethane;N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 144861482
9-ethenylcarbazole;2-ethenylisoindole-1,3-dione
CID 86733704
diethyl 2-benzylidenepropanedioate;9-ethenylcarbazole
CID 174971143

Frequently Asked Questions

What is the IUPAC name of 4-[(9-ethenylcarbazol-3-yl)amino]phenol?
The IUPAC name of 4-[(9-ethenylcarbazol-3-yl)amino]phenol (CID 56994296) is 4-[(9-ethenylcarbazol-3-yl)amino]phenol.
What is the SMILES notation for 4-[(9-ethenylcarbazol-3-yl)amino]phenol?
The canonical SMILES for 4-[(9-ethenylcarbazol-3-yl)amino]phenol is C=Cn1c2ccccc2c2cc(Nc3ccc(O)cc3)ccc21.
What is the InChIKey of 4-[(9-ethenylcarbazol-3-yl)amino]phenol?
The InChIKey is ZYNKQOIKNGJSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-2-22-19-6-4-3-5-17(19)18-13-15(9-12-20(18)22)21-14-7-10-16(23)11-8-14/h2-13,21,23H,1H2.
What are the key properties of 4-[(9-ethenylcarbazol-3-yl)amino]phenol?
4-[(9-ethenylcarbazol-3-yl)amino]phenol has a molecular weight of 300.36 g/mol, XLogP of 5.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(9-ethenylcarbazol-3-yl)amino]phenol is sourced from PubChem (CID 56994296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).