2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol

C15H12N2O2S — CID 170756201

IUPAC2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol
SMILESNc1ccc(Oc2ccccc2-c2cncs2)cc1O
InChIInChI=1S/C15H12N2O2S/c16-12-6-5-10(7-13(12)18)19-14-4-2-1-3-11(14)15-8-17-9-20-15/h1-9,18H,16H2
InChIKeyZWQDJUOHJFCYCQ-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.89
Rot. Bonds3

About 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol

2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol (PubChem CID 170756201) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol.

Molecular Properties

Compound Name2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol
PubChem CID170756201
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol
SMILESNc1ccc(Oc2ccccc2-c2cncs2)cc1O
InChIInChI=1S/C15H12N2O2S/c16-12-6-5-10(7-13(12)18)19-14-4-2-1-3-11(14)15-8-17-9-20-15/h1-9,18H,16H2
InChIKeyZWQDJUOHJFCYCQ-UHFFFAOYSA-N
XLogP3.89
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-amino-2-(4-amino-3-hydroxyphenoxy)phenol
CID 66776227
2-amino-5-[4-[10-[4-(4-methylphenoxy)phenyl]anthracen-9-yl]phenoxy]phenol
CID 22979018
2,3-bis(4-amino-3-hydroxyphenoxy)benzoic acid
CID 141051376
2-amino-4-[2-(3-amino-4-hydroxyphenoxy)-3-phenylphenoxy]phenol
CID 129308077
4-[2-(4-amino-3-hydroperoxyphenoxy)phenoxy]-2-hydroperoxyaniline
CID 161452691
2-amino-5-[3-(4-amino-3-hydroxyphenoxy)-2,4-bis(2-phenylethynyl)phenoxy]phenol
CID 139999367
3-(1,3-thiazol-5-yl)pyridin-4-amine
CID 130114568
2-aminophenol;2-(2-aminophenoxy)aniline
CID 174452334
2-amino-5-[2-(4-amino-3-hydroxyphenoxy)-3,4,5,6-tetrafluorophenoxy]phenol
CID 139971174
5-(2,3-difluorophenyl)-1,3-thiazole
CID 76539850
2-[6-(2-hydroxyphenoxy)naphthalen-2-yl]oxyphenol
CID 175775609
2-amino-5-[4-[9-[4-[4-methyl-2-(trifluoromethyl)phenoxy]phenyl]fluoren-9-yl]phenoxy]phenol
CID 22979019

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol?
The IUPAC name of 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol (CID 170756201) is 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol.
What is the SMILES notation for 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol?
The canonical SMILES for 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol is Nc1ccc(Oc2ccccc2-c2cncs2)cc1O.
What is the InChIKey of 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol?
The InChIKey is ZWQDJUOHJFCYCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c16-12-6-5-10(7-13(12)18)19-14-4-2-1-3-11(14)15-8-17-9-20-15/h1-9,18H,16H2.
What are the key properties of 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol?
2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol has a molecular weight of 284.34 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[2-(1,3-thiazol-5-yl)phenoxy]phenol is sourced from PubChem (CID 170756201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).