4-(3-amino-9-methylcarbazol-4-yl)phenol

C19H16N2O — CID 174504133

IUPAC4-(3-amino-9-methylcarbazol-4-yl)phenol
SMILESCn1c2ccccc2c2c(-c3ccc(O)cc3)c(N)ccc21
InChIInChI=1S/C19H16N2O/c1-21-16-5-3-2-4-14(16)19-17(21)11-10-15(20)18(19)12-6-8-13(22)9-7-12/h2-11,22H,20H2,1H3
InChIKeyGIZRJWLBLCCIDU-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.29
Rot. Bonds1

About 4-(3-amino-9-methylcarbazol-4-yl)phenol

4-(3-amino-9-methylcarbazol-4-yl)phenol (PubChem CID 174504133) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-(3-amino-9-methylcarbazol-4-yl)phenol.

Molecular Properties

Compound Name4-(3-amino-9-methylcarbazol-4-yl)phenol
PubChem CID174504133
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name4-(3-amino-9-methylcarbazol-4-yl)phenol
SMILESCn1c2ccccc2c2c(-c3ccc(O)cc3)c(N)ccc21
InChIInChI=1S/C19H16N2O/c1-21-16-5-3-2-4-14(16)19-17(21)11-10-15(20)18(19)12-6-8-13(22)9-7-12/h2-11,22H,20H2,1H3
InChIKeyGIZRJWLBLCCIDU-UHFFFAOYSA-N
XLogP4.29
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-9-methylcarbazol-4-yl)phenol?
The IUPAC name of 4-(3-amino-9-methylcarbazol-4-yl)phenol (CID 174504133) is 4-(3-amino-9-methylcarbazol-4-yl)phenol.
What is the SMILES notation for 4-(3-amino-9-methylcarbazol-4-yl)phenol?
The canonical SMILES for 4-(3-amino-9-methylcarbazol-4-yl)phenol is Cn1c2ccccc2c2c(-c3ccc(O)cc3)c(N)ccc21.
What is the InChIKey of 4-(3-amino-9-methylcarbazol-4-yl)phenol?
The InChIKey is GIZRJWLBLCCIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c1-21-16-5-3-2-4-14(16)19-17(21)11-10-15(20)18(19)12-6-8-13(22)9-7-12/h2-11,22H,20H2,1H3.
What are the key properties of 4-(3-amino-9-methylcarbazol-4-yl)phenol?
4-(3-amino-9-methylcarbazol-4-yl)phenol has a molecular weight of 288.35 g/mol, XLogP of 4.29, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-9-methylcarbazol-4-yl)phenol is sourced from PubChem (CID 174504133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).