2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol

C24H25NO — CID 67630948

IUPAC2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol
SMILESNc1ccccc1C1CCC(c2ccccc2)(c2ccccc2O)CC1
InChIInChI=1S/C24H25NO/c25-22-12-6-4-10-20(22)18-14-16-24(17-15-18,19-8-2-1-3-9-19)21-11-5-7-13-23(21)26/h1-13,18,26H,14-17,25H2
InChIKeyUTSAVVDMMHDSRR-UHFFFAOYSA-N
MW343.47 g/mol
LogP5.62
Rot. Bonds3

About 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol

2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol (PubChem CID 67630948) has the molecular formula C24H25NO and a molecular weight of 343.47 g/mol. Its IUPAC name is 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol.

Molecular Properties

Compound Name2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol
PubChem CID67630948
Molecular FormulaC24H25NO
Molecular Weight343.47 g/mol
Exact Mass343.19
IUPAC Name2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol
SMILESNc1ccccc1C1CCC(c2ccccc2)(c2ccccc2O)CC1
InChIInChI=1S/C24H25NO/c25-22-12-6-4-10-20(22)18-14-16-24(17-15-18,19-8-2-1-3-9-19)21-11-5-7-13-23(21)26/h1-13,18,26H,14-17,25H2
InChIKeyUTSAVVDMMHDSRR-UHFFFAOYSA-N
XLogP5.62
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.47
LogP ≤ 55.62
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 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol?
The IUPAC name of 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol (CID 67630948) is 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol.
What is the SMILES notation for 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol?
The canonical SMILES for 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol is Nc1ccccc1C1CCC(c2ccccc2)(c2ccccc2O)CC1.
What is the InChIKey of 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol?
The InChIKey is UTSAVVDMMHDSRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO/c25-22-12-6-4-10-20(22)18-14-16-24(17-15-18,19-8-2-1-3-9-19)21-11-5-7-13-23(21)26/h1-13,18,26H,14-17,25H2.
What are the key properties of 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol?
2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol has a molecular weight of 343.47 g/mol, XLogP of 5.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminophenyl)-1-phenylcyclohexyl]phenol is sourced from PubChem (CID 67630948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).