2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol

C14H15NO3 — CID 117241436

IUPAC2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol
SMILESOCC(COc1ccccc1O)c1ccccn1
InChIInChI=1S/C14H15NO3/c16-9-11(12-5-3-4-8-15-12)10-18-14-7-2-1-6-13(14)17/h1-8,11,16-17H,9-10H2
InChIKeyTYUCFDZQQFCCSH-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.94
Rot. Bonds5

About 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol

2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol (PubChem CID 117241436) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol.

Molecular Properties

Compound Name2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol
PubChem CID117241436
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol
SMILESOCC(COc1ccccc1O)c1ccccn1
InChIInChI=1S/C14H15NO3/c16-9-11(12-5-3-4-8-15-12)10-18-14-7-2-1-6-13(14)17/h1-8,11,16-17H,9-10H2
InChIKeyTYUCFDZQQFCCSH-UHFFFAOYSA-N
XLogP1.94
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3-hydroxy-2-pyridin-2-ylpropyl) carbamate
CID 10420201
(3-hydroxy-2-pyridin-2-ylpropyl) acetate
CID 22101011
2-(3-hydroxy-2-pyridin-3-ylpropoxy)phenol
CID 117241268
3-phenyl-2-pyridin-2-ylpropan-1-ol
CID 68653958
2-(2-bromophenoxy)-1-pyridin-2-ylethanol
CID 117241374
2-(1,3-dichloropropan-2-yl)pyridine
CID 14046520
(2S)-2-amino-2-pyridin-2-ylethanol
CID 55278064
3-(cyclopropylamino)-2-pyridin-2-ylpropan-1-ol
CID 117241410
(2R)-2-amino-2-pyridin-2-ylethanol;hydrochloride
CID 86306039
2-[3-amino-2-(4-hydroxyphenyl)propoxy]phenol
CID 117244893
4-(3-amino-2-pyridin-2-ylpropyl)-2-ethoxyphenol
CID 83975818
ethane;2-pentan-3-ylpyridine
CID 142883968

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol?
The IUPAC name of 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol (CID 117241436) is 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol.
What is the SMILES notation for 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol?
The canonical SMILES for 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol is OCC(COc1ccccc1O)c1ccccn1.
What is the InChIKey of 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol?
The InChIKey is TYUCFDZQQFCCSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c16-9-11(12-5-3-4-8-15-12)10-18-14-7-2-1-6-13(14)17/h1-8,11,16-17H,9-10H2.
What are the key properties of 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol?
2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol has a molecular weight of 245.28 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-2-pyridin-2-ylpropoxy)phenol is sourced from PubChem (CID 117241436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).