2-amino-4-carbazol-9-ylphenol

C18H14N2O — CID 146221532

IUPAC2-amino-4-carbazol-9-ylphenol
SMILESNc1cc(-n2c3ccccc3c3ccccc32)ccc1O
InChIInChI=1S/C18H14N2O/c19-15-11-12(9-10-18(15)21)20-16-7-3-1-5-13(16)14-6-2-4-8-17(14)20/h1-11,21H,19H2
InChIKeyKDSIBSOTXQUHHM-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.07
Rot. Bonds1

About 2-amino-4-carbazol-9-ylphenol

2-amino-4-carbazol-9-ylphenol (PubChem CID 146221532) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-amino-4-carbazol-9-ylphenol.

Molecular Properties

Compound Name2-amino-4-carbazol-9-ylphenol
PubChem CID146221532
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name2-amino-4-carbazol-9-ylphenol
SMILESNc1cc(-n2c3ccccc3c3ccccc32)ccc1O
InChIInChI=1S/C18H14N2O/c19-15-11-12(9-10-18(15)21)20-16-7-3-1-5-13(16)14-6-2-4-8-17(14)20/h1-11,21H,19H2
InChIKeyKDSIBSOTXQUHHM-UHFFFAOYSA-N
XLogP4.07
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-carbazol-9-ylphenol?
The IUPAC name of 2-amino-4-carbazol-9-ylphenol (CID 146221532) is 2-amino-4-carbazol-9-ylphenol.
What is the SMILES notation for 2-amino-4-carbazol-9-ylphenol?
The canonical SMILES for 2-amino-4-carbazol-9-ylphenol is Nc1cc(-n2c3ccccc3c3ccccc32)ccc1O.
What is the InChIKey of 2-amino-4-carbazol-9-ylphenol?
The InChIKey is KDSIBSOTXQUHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c19-15-11-12(9-10-18(15)21)20-16-7-3-1-5-13(16)14-6-2-4-8-17(14)20/h1-11,21H,19H2.
What are the key properties of 2-amino-4-carbazol-9-ylphenol?
2-amino-4-carbazol-9-ylphenol has a molecular weight of 274.32 g/mol, XLogP of 4.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-carbazol-9-ylphenol is sourced from PubChem (CID 146221532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).