2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline

C24H28N2 — CID 18997970

IUPAC2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
SMILESCC(C)(c1ccc(C(C)(C)c2ccccc2N)cc1)c1ccccc1N
InChIInChI=1S/C24H28N2/c1-23(2,19-9-5-7-11-21(19)25)17-13-15-18(16-14-17)24(3,4)20-10-6-8-12-22(20)26/h5-16H,25-26H2,1-4H3
InChIKeyWKFKEQGZVAADHO-UHFFFAOYSA-N
MW344.50 g/mol
LogP5.50
Rot. Bonds4

About 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline

2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline (PubChem CID 18997970) has the molecular formula C24H28N2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline.

Molecular Properties

Compound Name2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
PubChem CID18997970
Molecular FormulaC24H28N2
Molecular Weight344.50 g/mol
Exact Mass344.23
IUPAC Name2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
SMILESCC(C)(c1ccc(C(C)(C)c2ccccc2N)cc1)c1ccccc1N
InChIInChI=1S/C24H28N2/c1-23(2,19-9-5-7-11-21(19)25)17-13-15-18(16-14-17)24(3,4)20-10-6-8-12-22(20)26/h5-16H,25-26H2,1-4H3
InChIKeyWKFKEQGZVAADHO-UHFFFAOYSA-N
XLogP5.50
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 55.50
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-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline?
The IUPAC name of 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline (CID 18997970) is 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline.
What is the SMILES notation for 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline?
The canonical SMILES for 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline is CC(C)(c1ccc(C(C)(C)c2ccccc2N)cc1)c1ccccc1N.
What is the InChIKey of 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline?
The InChIKey is WKFKEQGZVAADHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2/c1-23(2,19-9-5-7-11-21(19)25)17-13-15-18(16-14-17)24(3,4)20-10-6-8-12-22(20)26/h5-16H,25-26H2,1-4H3.
What are the key properties of 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline?
2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline has a molecular weight of 344.50 g/mol, XLogP of 5.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline is sourced from PubChem (CID 18997970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).