4-[(E)-carbazol-9-yliminomethyl]phenol

C19H14N2O — CID 135490284

IUPAC4-[(E)-carbazol-9-yliminomethyl]phenol
SMILESOc1ccc(/C=N/n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H14N2O/c22-15-11-9-14(10-12-15)13-20-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-13,22H/b20-13+
InChIKeyFVZQRLHCNICBKC-DEDYPNTBSA-N
MW286.33 g/mol
LogP4.38
Rot. Bonds2

About 4-[(E)-carbazol-9-yliminomethyl]phenol

4-[(E)-carbazol-9-yliminomethyl]phenol (PubChem CID 135490284) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-[(E)-carbazol-9-yliminomethyl]phenol.

Molecular Properties

Compound Name4-[(E)-carbazol-9-yliminomethyl]phenol
PubChem CID135490284
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC Name4-[(E)-carbazol-9-yliminomethyl]phenol
SMILESOc1ccc(/C=N/n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H14N2O/c22-15-11-9-14(10-12-15)13-20-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-13,22H/b20-13+
InChIKeyFVZQRLHCNICBKC-DEDYPNTBSA-N
XLogP4.38
TPSA37.52 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-carbazol-9-yliminomethyl]phenol?
The IUPAC name of 4-[(E)-carbazol-9-yliminomethyl]phenol (CID 135490284) is 4-[(E)-carbazol-9-yliminomethyl]phenol.
What is the SMILES notation for 4-[(E)-carbazol-9-yliminomethyl]phenol?
The canonical SMILES for 4-[(E)-carbazol-9-yliminomethyl]phenol is Oc1ccc(/C=N/n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 4-[(E)-carbazol-9-yliminomethyl]phenol?
The InChIKey is FVZQRLHCNICBKC-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H14N2O/c22-15-11-9-14(10-12-15)13-20-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-13,22H/b20-13+.
What are the key properties of 4-[(E)-carbazol-9-yliminomethyl]phenol?
4-[(E)-carbazol-9-yliminomethyl]phenol has a molecular weight of 286.33 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-carbazol-9-yliminomethyl]phenol is sourced from PubChem (CID 135490284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).