(4-aminophenyl)-(9H-fluoren-2-yl)methanol

C20H17NO — CID 91678822

IUPAC(4-aminophenyl)-(9H-fluoren-2-yl)methanol
SMILESNc1ccc(C(O)c2ccc3c(c2)Cc2ccccc2-3)cc1
InChIInChI=1S/C20H17NO/c21-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-1-2-4-18(14)19/h1-10,12,20,22H,11,21H2
InChIKeyAYOAXPIBPNLUTC-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.92
Rot. Bonds2

About (4-aminophenyl)-(9H-fluoren-2-yl)methanol

(4-aminophenyl)-(9H-fluoren-2-yl)methanol (PubChem CID 91678822) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is (4-aminophenyl)-(9H-fluoren-2-yl)methanol.

Molecular Properties

Compound Name(4-aminophenyl)-(9H-fluoren-2-yl)methanol
PubChem CID91678822
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name(4-aminophenyl)-(9H-fluoren-2-yl)methanol
SMILESNc1ccc(C(O)c2ccc3c(c2)Cc2ccccc2-3)cc1
InChIInChI=1S/C20H17NO/c21-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-1-2-4-18(14)19/h1-10,12,20,22H,11,21H2
InChIKeyAYOAXPIBPNLUTC-UHFFFAOYSA-N
XLogP3.92
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-aminophenyl)-(9H-fluoren-2-yl)methanol?
The IUPAC name of (4-aminophenyl)-(9H-fluoren-2-yl)methanol (CID 91678822) is (4-aminophenyl)-(9H-fluoren-2-yl)methanol.
What is the SMILES notation for (4-aminophenyl)-(9H-fluoren-2-yl)methanol?
The canonical SMILES for (4-aminophenyl)-(9H-fluoren-2-yl)methanol is Nc1ccc(C(O)c2ccc3c(c2)Cc2ccccc2-3)cc1.
What is the InChIKey of (4-aminophenyl)-(9H-fluoren-2-yl)methanol?
The InChIKey is AYOAXPIBPNLUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c21-17-8-5-13(6-9-17)20(22)15-7-10-19-16(12-15)11-14-3-1-2-4-18(14)19/h1-10,12,20,22H,11,21H2.
What are the key properties of (4-aminophenyl)-(9H-fluoren-2-yl)methanol?
(4-aminophenyl)-(9H-fluoren-2-yl)methanol has a molecular weight of 287.36 g/mol, XLogP of 3.92, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-(9H-fluoren-2-yl)methanol is sourced from PubChem (CID 91678822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).