4-[(2-piperidin-2-ylcyclopentyl)amino]phenol

C16H24N2O — CID 79545447

IUPAC4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
SMILESOc1ccc(NC2CCCC2C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O/c19-13-9-7-12(8-10-13)18-16-6-3-4-14(16)15-5-1-2-11-17-15/h7-10,14-19H,1-6,11H2
InChIKeyCITHRIRNGLPFJL-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.11
Rot. Bonds3

About 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol

4-[(2-piperidin-2-ylcyclopentyl)amino]phenol (PubChem CID 79545447) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol.

Molecular Properties

Compound Name4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
PubChem CID79545447
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
SMILESOc1ccc(NC2CCCC2C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O/c19-13-9-7-12(8-10-13)18-16-6-3-4-14(16)15-5-1-2-11-17-15/h7-10,14-19H,1-6,11H2
InChIKeyCITHRIRNGLPFJL-UHFFFAOYSA-N
XLogP3.11
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol?
The IUPAC name of 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol (CID 79545447) is 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol.
What is the SMILES notation for 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol?
The canonical SMILES for 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol is Oc1ccc(NC2CCCC2C2CCCCN2)cc1.
What is the InChIKey of 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol?
The InChIKey is CITHRIRNGLPFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c19-13-9-7-12(8-10-13)18-16-6-3-4-14(16)15-5-1-2-11-17-15/h7-10,14-19H,1-6,11H2.
What are the key properties of 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol?
4-[(2-piperidin-2-ylcyclopentyl)amino]phenol has a molecular weight of 260.38 g/mol, XLogP of 3.11, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-piperidin-2-ylcyclopentyl)amino]phenol is sourced from PubChem (CID 79545447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).