[4-(4-piperidin-4-ylphenyl)phenyl]methanamine

C18H22N2 — CID 116988072

IUPAC[4-(4-piperidin-4-ylphenyl)phenyl]methanamine
SMILESNCc1ccc(-c2ccc(C3CCNCC3)cc2)cc1
InChIInChI=1S/C18H22N2/c19-13-14-1-3-15(4-2-14)16-5-7-17(8-6-16)18-9-11-20-12-10-18/h1-8,18,20H,9-13,19H2
InChIKeyDIIVXGYWHUTKEX-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.28
Rot. Bonds3

About [4-(4-piperidin-4-ylphenyl)phenyl]methanamine

[4-(4-piperidin-4-ylphenyl)phenyl]methanamine (PubChem CID 116988072) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is [4-(4-piperidin-4-ylphenyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(4-piperidin-4-ylphenyl)phenyl]methanamine
PubChem CID116988072
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name[4-(4-piperidin-4-ylphenyl)phenyl]methanamine
SMILESNCc1ccc(-c2ccc(C3CCNCC3)cc2)cc1
InChIInChI=1S/C18H22N2/c19-13-14-1-3-15(4-2-14)16-5-7-17(8-6-16)18-9-11-20-12-10-18/h1-8,18,20H,9-13,19H2
InChIKeyDIIVXGYWHUTKEX-UHFFFAOYSA-N
XLogP3.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(4-piperidin-4-ylphenyl)phenyl]methanamine?
The IUPAC name of [4-(4-piperidin-4-ylphenyl)phenyl]methanamine (CID 116988072) is [4-(4-piperidin-4-ylphenyl)phenyl]methanamine.
What is the SMILES notation for [4-(4-piperidin-4-ylphenyl)phenyl]methanamine?
The canonical SMILES for [4-(4-piperidin-4-ylphenyl)phenyl]methanamine is NCc1ccc(-c2ccc(C3CCNCC3)cc2)cc1.
What is the InChIKey of [4-(4-piperidin-4-ylphenyl)phenyl]methanamine?
The InChIKey is DIIVXGYWHUTKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c19-13-14-1-3-15(4-2-14)16-5-7-17(8-6-16)18-9-11-20-12-10-18/h1-8,18,20H,9-13,19H2.
What are the key properties of [4-(4-piperidin-4-ylphenyl)phenyl]methanamine?
[4-(4-piperidin-4-ylphenyl)phenyl]methanamine has a molecular weight of 266.39 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-piperidin-4-ylphenyl)phenyl]methanamine is sourced from PubChem (CID 116988072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).