2-(2-piperidin-2-ylethyliminomethyl)phenol

C14H20N2O — CID 171378054

IUPAC2-(2-piperidin-2-ylethyliminomethyl)phenol
SMILESOc1ccccc1/C=N/CCC1CCCCN1
InChIInChI=1S/C14H20N2O/c17-14-7-2-1-5-12(14)11-15-10-8-13-6-3-4-9-16-13/h1-2,5,7,11,13,16-17H,3-4,6,8-10H2/b15-11+
InChIKeyDNJKGGREWIBIQG-RVDMUPIBSA-N
MW232.33 g/mol
LogP2.34
Rot. Bonds4

About 2-(2-piperidin-2-ylethyliminomethyl)phenol

2-(2-piperidin-2-ylethyliminomethyl)phenol (PubChem CID 171378054) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(2-piperidin-2-ylethyliminomethyl)phenol.

Molecular Properties

Compound Name2-(2-piperidin-2-ylethyliminomethyl)phenol
PubChem CID171378054
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(2-piperidin-2-ylethyliminomethyl)phenol
SMILESOc1ccccc1/C=N/CCC1CCCCN1
InChIInChI=1S/C14H20N2O/c17-14-7-2-1-5-12(14)11-15-10-8-13-6-3-4-9-16-13/h1-2,5,7,11,13,16-17H,3-4,6,8-10H2/b15-11+
InChIKeyDNJKGGREWIBIQG-RVDMUPIBSA-N
XLogP2.34
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-piperidin-2-ylethyliminomethyl)phenol?
The IUPAC name of 2-(2-piperidin-2-ylethyliminomethyl)phenol (CID 171378054) is 2-(2-piperidin-2-ylethyliminomethyl)phenol.
What is the SMILES notation for 2-(2-piperidin-2-ylethyliminomethyl)phenol?
The canonical SMILES for 2-(2-piperidin-2-ylethyliminomethyl)phenol is Oc1ccccc1/C=N/CCC1CCCCN1.
What is the InChIKey of 2-(2-piperidin-2-ylethyliminomethyl)phenol?
The InChIKey is DNJKGGREWIBIQG-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H20N2O/c17-14-7-2-1-5-12(14)11-15-10-8-13-6-3-4-9-16-13/h1-2,5,7,11,13,16-17H,3-4,6,8-10H2/b15-11+.
What are the key properties of 2-(2-piperidin-2-ylethyliminomethyl)phenol?
2-(2-piperidin-2-ylethyliminomethyl)phenol has a molecular weight of 232.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperidin-2-ylethyliminomethyl)phenol is sourced from PubChem (CID 171378054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).