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

C17H26N2O — CID 79553578

IUPAC4-[(2-piperidin-2-ylcyclohexyl)amino]phenol
SMILESOc1ccc(NC2CCCCC2C2CCCCN2)cc1
InChIInChI=1S/C17H26N2O/c20-14-10-8-13(9-11-14)19-17-7-2-1-5-15(17)16-6-3-4-12-18-16/h8-11,15-20H,1-7,12H2
InChIKeyYNIUPZAIQWJPES-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.51
Rot. Bonds3

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

4-[(2-piperidin-2-ylcyclohexyl)amino]phenol (PubChem CID 79553578) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol.

Molecular Properties

Compound Name4-[(2-piperidin-2-ylcyclohexyl)amino]phenol
PubChem CID79553578
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name4-[(2-piperidin-2-ylcyclohexyl)amino]phenol
SMILESOc1ccc(NC2CCCCC2C2CCCCN2)cc1
InChIInChI=1S/C17H26N2O/c20-14-10-8-13(9-11-14)19-17-7-2-1-5-15(17)16-6-3-4-12-18-16/h8-11,15-20H,1-7,12H2
InChIKeyYNIUPZAIQWJPES-UHFFFAOYSA-N
XLogP3.51
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
CID 79545447
2-methyl-5-[(2-pyrrolidin-2-ylcyclohexyl)amino]phenol
CID 107700278
N-(2-piperidin-2-ylcyclopentyl)thiophen-3-amine
CID 79545411
4-nitro-N-(2-pyrrolidin-2-ylcyclohexyl)aniline
CID 79536425
4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol
CID 79536288
4-methoxy-N-(2-pyrrolidin-2-ylcyclopentyl)aniline
CID 79543661
3,5-difluoro-N-(2-piperidin-2-ylcyclopentyl)aniline
CID 79545806
N-(2-piperidin-2-ylcyclopentyl)pyrimidin-5-amine
CID 107587753
3,4,5-trifluoro-N-(2-piperidin-2-ylcyclopentyl)aniline
CID 79537664
N-(2-pyrrolidin-2-ylcyclohexyl)-1H-indazol-5-amine
CID 79536417
N-(2-pyrrolidin-2-ylcyclopentyl)-1,3-benzodioxol-5-amine
CID 79536079
2-chloro-5-[(2-piperidin-2-ylcyclopentyl)amino]benzonitrile
CID 79537026

Frequently Asked Questions

What is the IUPAC name of 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol?
The IUPAC name of 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol (CID 79553578) is 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol.
What is the SMILES notation for 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol?
The canonical SMILES for 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol is Oc1ccc(NC2CCCCC2C2CCCCN2)cc1.
What is the InChIKey of 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol?
The InChIKey is YNIUPZAIQWJPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c20-14-10-8-13(9-11-14)19-17-7-2-1-5-15(17)16-6-3-4-12-18-16/h8-11,15-20H,1-7,12H2.
What are the key properties of 4-[(2-piperidin-2-ylcyclohexyl)amino]phenol?
4-[(2-piperidin-2-ylcyclohexyl)amino]phenol has a molecular weight of 274.41 g/mol, XLogP of 3.51, 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-ylcyclohexyl)amino]phenol is sourced from PubChem (CID 79553578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).