(2-aminophenyl)-bis(4-methylphenyl)methanol

C21H21NO — CID 2975188

IUPAC(2-aminophenyl)-bis(4-methylphenyl)methanol
SMILESCc1ccc(C(O)(c2ccc(C)cc2)c2ccccc2N)cc1
InChIInChI=1S/C21H21NO/c1-15-7-11-17(12-8-15)21(23,18-13-9-16(2)10-14-18)19-5-3-4-6-20(19)22/h3-14,23H,22H2,1-2H3
InChIKeyJIYYWAUNYNSVSG-UHFFFAOYSA-N
MW303.41 g/mol
LogP4.17
Rot. Bonds3

About (2-aminophenyl)-bis(4-methylphenyl)methanol

(2-aminophenyl)-bis(4-methylphenyl)methanol (PubChem CID 2975188) has the molecular formula C21H21NO and a molecular weight of 303.41 g/mol. Its IUPAC name is (2-aminophenyl)-bis(4-methylphenyl)methanol.

Molecular Properties

Compound Name(2-aminophenyl)-bis(4-methylphenyl)methanol
PubChem CID2975188
Molecular FormulaC21H21NO
Molecular Weight303.41 g/mol
Exact Mass303.16
IUPAC Name(2-aminophenyl)-bis(4-methylphenyl)methanol
SMILESCc1ccc(C(O)(c2ccc(C)cc2)c2ccccc2N)cc1
InChIInChI=1S/C21H21NO/c1-15-7-11-17(12-8-15)21(23,18-13-9-16(2)10-14-18)19-5-3-4-6-20(19)22/h3-14,23H,22H2,1-2H3
InChIKeyJIYYWAUNYNSVSG-UHFFFAOYSA-N
XLogP4.17
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-aminophenyl)-bis(4-methylphenyl)methanol?
The IUPAC name of (2-aminophenyl)-bis(4-methylphenyl)methanol (CID 2975188) is (2-aminophenyl)-bis(4-methylphenyl)methanol.
What is the SMILES notation for (2-aminophenyl)-bis(4-methylphenyl)methanol?
The canonical SMILES for (2-aminophenyl)-bis(4-methylphenyl)methanol is Cc1ccc(C(O)(c2ccc(C)cc2)c2ccccc2N)cc1.
What is the InChIKey of (2-aminophenyl)-bis(4-methylphenyl)methanol?
The InChIKey is JIYYWAUNYNSVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO/c1-15-7-11-17(12-8-15)21(23,18-13-9-16(2)10-14-18)19-5-3-4-6-20(19)22/h3-14,23H,22H2,1-2H3.
What are the key properties of (2-aminophenyl)-bis(4-methylphenyl)methanol?
(2-aminophenyl)-bis(4-methylphenyl)methanol has a molecular weight of 303.41 g/mol, XLogP of 4.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminophenyl)-bis(4-methylphenyl)methanol is sourced from PubChem (CID 2975188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).