2-(2-amino-2-piperidin-4-ylethoxy)phenol

C13H20N2O2 — CID 117238741

IUPAC2-(2-amino-2-piperidin-4-ylethoxy)phenol
SMILESNC(COc1ccccc1O)C1CCNCC1
InChIInChI=1S/C13H20N2O2/c14-11(10-5-7-15-8-6-10)9-17-13-4-2-1-3-12(13)16/h1-4,10-11,15-16H,5-9,14H2
InChIKeyQCKHRNZGTAIEBN-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.10
Rot. Bonds4

About 2-(2-amino-2-piperidin-4-ylethoxy)phenol

2-(2-amino-2-piperidin-4-ylethoxy)phenol (PubChem CID 117238741) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(2-amino-2-piperidin-4-ylethoxy)phenol.

Molecular Properties

Compound Name2-(2-amino-2-piperidin-4-ylethoxy)phenol
PubChem CID117238741
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(2-amino-2-piperidin-4-ylethoxy)phenol
SMILESNC(COc1ccccc1O)C1CCNCC1
InChIInChI=1S/C13H20N2O2/c14-11(10-5-7-15-8-6-10)9-17-13-4-2-1-3-12(13)16/h1-4,10-11,15-16H,5-9,14H2
InChIKeyQCKHRNZGTAIEBN-UHFFFAOYSA-N
XLogP1.10
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-amino-2-(1-methylpyrrolidin-3-yl)ethoxy]phenol
CID 117237295
2-[2-amino-2-(1-ethylpyrrolidin-3-yl)ethoxy]phenol
CID 117237323
2-[2-amino-2-(1-propan-2-ylpyrrolidin-3-yl)ethoxy]phenol
CID 117237325
2-(3-bromophenoxy)-1-piperidin-4-ylethanamine
CID 117238821
1-cyclopropyl-2-(2-propoxyphenoxy)ethanamine
CID 63913161
2-[3-amino-2-(oxolan-3-yl)propoxy]phenol
CID 117237737
1-cyclopropyl-2-(2,3-difluorophenoxy)ethanamine
CID 63905866
2-(2-hydroxy-3-piperazin-1-ium-1-ylpropoxy)phenol
CID 145050902
2-(2-fluorophenoxy)-1-(oxan-4-yl)ethanamine
CID 117238680
2-(2-bromophenoxy)-1-(oxan-4-yl)ethanamine
CID 117238682
4-[(R)-amino(piperidin-4-yl)methyl]-2-ethoxyphenol;hydrochloride
CID 171314179
2-cyclobutyl-3-(2-hydroxyphenoxy)propanoic acid
CID 117245713

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-piperidin-4-ylethoxy)phenol?
The IUPAC name of 2-(2-amino-2-piperidin-4-ylethoxy)phenol (CID 117238741) is 2-(2-amino-2-piperidin-4-ylethoxy)phenol.
What is the SMILES notation for 2-(2-amino-2-piperidin-4-ylethoxy)phenol?
The canonical SMILES for 2-(2-amino-2-piperidin-4-ylethoxy)phenol is NC(COc1ccccc1O)C1CCNCC1.
What is the InChIKey of 2-(2-amino-2-piperidin-4-ylethoxy)phenol?
The InChIKey is QCKHRNZGTAIEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c14-11(10-5-7-15-8-6-10)9-17-13-4-2-1-3-12(13)16/h1-4,10-11,15-16H,5-9,14H2.
What are the key properties of 2-(2-amino-2-piperidin-4-ylethoxy)phenol?
2-(2-amino-2-piperidin-4-ylethoxy)phenol has a molecular weight of 236.31 g/mol, XLogP of 1.10, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-piperidin-4-ylethoxy)phenol is sourced from PubChem (CID 117238741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).