2-(carbazol-9-ylamino)-4-methylphenol

C19H16N2O — CID 10379360

IUPAC2-(carbazol-9-ylamino)-4-methylphenol
SMILESCc1ccc(O)c(Nn2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C19H16N2O/c1-13-10-11-19(22)16(12-13)20-21-17-8-4-2-6-14(17)15-7-3-5-9-18(15)21/h2-12,20,22H,1H3
InChIKeyAPDRMDFEHWWPNI-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.68
Rot. Bonds2

About 2-(carbazol-9-ylamino)-4-methylphenol

2-(carbazol-9-ylamino)-4-methylphenol (PubChem CID 10379360) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(carbazol-9-ylamino)-4-methylphenol.

Molecular Properties

Compound Name2-(carbazol-9-ylamino)-4-methylphenol
PubChem CID10379360
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name2-(carbazol-9-ylamino)-4-methylphenol
SMILESCc1ccc(O)c(Nn2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C19H16N2O/c1-13-10-11-19(22)16(12-13)20-21-17-8-4-2-6-14(17)15-7-3-5-9-18(15)21/h2-12,20,22H,1H3
InChIKeyAPDRMDFEHWWPNI-UHFFFAOYSA-N
XLogP4.68
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(carbazol-9-ylamino)-4-methylphenol?
The IUPAC name of 2-(carbazol-9-ylamino)-4-methylphenol (CID 10379360) is 2-(carbazol-9-ylamino)-4-methylphenol.
What is the SMILES notation for 2-(carbazol-9-ylamino)-4-methylphenol?
The canonical SMILES for 2-(carbazol-9-ylamino)-4-methylphenol is Cc1ccc(O)c(Nn2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 2-(carbazol-9-ylamino)-4-methylphenol?
The InChIKey is APDRMDFEHWWPNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-13-10-11-19(22)16(12-13)20-21-17-8-4-2-6-14(17)15-7-3-5-9-18(15)21/h2-12,20,22H,1H3.
What are the key properties of 2-(carbazol-9-ylamino)-4-methylphenol?
2-(carbazol-9-ylamino)-4-methylphenol has a molecular weight of 288.35 g/mol, XLogP of 4.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbazol-9-ylamino)-4-methylphenol is sourced from PubChem (CID 10379360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).