4-[1-(4-aminophenyl)cyclohexyl]aniline

C18H22N2 — CID 768325

IUPAC4-[1-(4-aminophenyl)cyclohexyl]aniline
SMILESNc1ccc(C2(c3ccc(N)cc3)CCCCC2)cc1
InChIInChI=1S/C18H22N2/c19-16-8-4-14(5-9-16)18(12-2-1-3-13-18)15-6-10-17(20)11-7-15/h4-11H,1-3,12-13,19-20H2
InChIKeyZSQIQUAKDNTQOI-UHFFFAOYSA-N
MW266.39 g/mol
LogP4.10
Rot. Bonds2

About 4-[1-(4-aminophenyl)cyclohexyl]aniline

4-[1-(4-aminophenyl)cyclohexyl]aniline (PubChem CID 768325) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-[1-(4-aminophenyl)cyclohexyl]aniline.

Molecular Properties

Compound Name4-[1-(4-aminophenyl)cyclohexyl]aniline
PubChem CID768325
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name4-[1-(4-aminophenyl)cyclohexyl]aniline
SMILESNc1ccc(C2(c3ccc(N)cc3)CCCCC2)cc1
InChIInChI=1S/C18H22N2/c19-16-8-4-14(5-9-16)18(12-2-1-3-13-18)15-6-10-17(20)11-7-15/h4-11H,1-3,12-13,19-20H2
InChIKeyZSQIQUAKDNTQOI-UHFFFAOYSA-N
XLogP4.10
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_F(14)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-aminophenyl)cyclohexyl]aniline?
The IUPAC name of 4-[1-(4-aminophenyl)cyclohexyl]aniline (CID 768325) is 4-[1-(4-aminophenyl)cyclohexyl]aniline.
What is the SMILES notation for 4-[1-(4-aminophenyl)cyclohexyl]aniline?
The canonical SMILES for 4-[1-(4-aminophenyl)cyclohexyl]aniline is Nc1ccc(C2(c3ccc(N)cc3)CCCCC2)cc1.
What is the InChIKey of 4-[1-(4-aminophenyl)cyclohexyl]aniline?
The InChIKey is ZSQIQUAKDNTQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c19-16-8-4-14(5-9-16)18(12-2-1-3-13-18)15-6-10-17(20)11-7-15/h4-11H,1-3,12-13,19-20H2.
What are the key properties of 4-[1-(4-aminophenyl)cyclohexyl]aniline?
4-[1-(4-aminophenyl)cyclohexyl]aniline has a molecular weight of 266.39 g/mol, XLogP of 4.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-aminophenyl)cyclohexyl]aniline is sourced from PubChem (CID 768325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).