2-[2-(2-aminophenoxy)propan-2-yl]phenol

C15H17NO2 — CID 139654636

IUPAC2-[2-(2-aminophenoxy)propan-2-yl]phenol
SMILESCC(C)(Oc1ccccc1N)c1ccccc1O
InChIInChI=1S/C15H17NO2/c1-15(2,11-7-3-5-9-13(11)17)18-14-10-6-4-8-12(14)16/h3-10,17H,16H2,1-2H3
InChIKeySEXYSVQSALJPBA-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.29
Rot. Bonds3

About 2-[2-(2-aminophenoxy)propan-2-yl]phenol

2-[2-(2-aminophenoxy)propan-2-yl]phenol (PubChem CID 139654636) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[2-(2-aminophenoxy)propan-2-yl]phenol.

Molecular Properties

Compound Name2-[2-(2-aminophenoxy)propan-2-yl]phenol
PubChem CID139654636
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-[2-(2-aminophenoxy)propan-2-yl]phenol
SMILESCC(C)(Oc1ccccc1N)c1ccccc1O
InChIInChI=1S/C15H17NO2/c1-15(2,11-7-3-5-9-13(11)17)18-14-10-6-4-8-12(14)16/h3-10,17H,16H2,1-2H3
InChIKeySEXYSVQSALJPBA-UHFFFAOYSA-N
XLogP3.29
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-pyridin-2-ylpropan-2-yloxy)aniline
CID 117095525
2-(1-amino-2-methylpropan-2-yl)oxyaniline
CID 117095493
2-aminophenol;2-(2-aminophenoxy)aniline
CID 174452334
2-(1,1-diphenoxyethyl)phenol
CID 66866287
2-(trifluoromethoxy)aniline;dihydrochloride
CID 69022411
2-tert-butylphenol;N-methylmethanamine
CID 161387965
2-[2-(2-phenylpropan-2-yl)phenoxy]aniline
CID 67055511
2-[2-[2-(2-hydroxyphenyl)propan-2-yloxyphosphanyloxy]phenyl]phenol
CID 142850685
2-[2-(2-hydroxyphenyl)propan-2-yl]phenol;hydrate
CID 162321834
2-tert-butylaniline
CID 159041627
CID 172777673
CID 172777673
2-(2-bromo-1,1,2,2-tetrafluoroethoxy)aniline
CID 87396327

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminophenoxy)propan-2-yl]phenol?
The IUPAC name of 2-[2-(2-aminophenoxy)propan-2-yl]phenol (CID 139654636) is 2-[2-(2-aminophenoxy)propan-2-yl]phenol.
What is the SMILES notation for 2-[2-(2-aminophenoxy)propan-2-yl]phenol?
The canonical SMILES for 2-[2-(2-aminophenoxy)propan-2-yl]phenol is CC(C)(Oc1ccccc1N)c1ccccc1O.
What is the InChIKey of 2-[2-(2-aminophenoxy)propan-2-yl]phenol?
The InChIKey is SEXYSVQSALJPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-15(2,11-7-3-5-9-13(11)17)18-14-10-6-4-8-12(14)16/h3-10,17H,16H2,1-2H3.
What are the key properties of 2-[2-(2-aminophenoxy)propan-2-yl]phenol?
2-[2-(2-aminophenoxy)propan-2-yl]phenol has a molecular weight of 243.31 g/mol, XLogP of 3.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminophenoxy)propan-2-yl]phenol is sourced from PubChem (CID 139654636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).