4-(1-pyridin-2-ylethylamino)phenol

C13H14N2O — CID 43742707

IUPAC4-(1-pyridin-2-ylethylamino)phenol
SMILESCC(Nc1ccc(O)cc1)c1ccccn1
InChIInChI=1S/C13H14N2O/c1-10(13-4-2-3-9-14-13)15-11-5-7-12(16)8-6-11/h2-10,15-16H,1H3
InChIKeyVHILKWTUWRGZFY-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.96
Rot. Bonds3

About 4-(1-pyridin-2-ylethylamino)phenol

4-(1-pyridin-2-ylethylamino)phenol (PubChem CID 43742707) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(1-pyridin-2-ylethylamino)phenol.

Molecular Properties

Compound Name4-(1-pyridin-2-ylethylamino)phenol
PubChem CID43742707
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-(1-pyridin-2-ylethylamino)phenol
SMILESCC(Nc1ccc(O)cc1)c1ccccn1
InChIInChI=1S/C13H14N2O/c1-10(13-4-2-3-9-14-13)15-11-5-7-12(16)8-6-11/h2-10,15-16H,1H3
InChIKeyVHILKWTUWRGZFY-UHFFFAOYSA-N
XLogP2.96
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-(1-pyridin-2-ylethyl)aniline
CID 43194293
N-(1-pyridin-2-ylethyl)-4-(trifluoromethyl)aniline
CID 43192853
N-[4-(1-pyridin-2-ylethylamino)phenyl]propanamide
CID 43720633
5-(1-pyridin-2-ylethylamino)naphthalen-1-ol
CID 43742985
2-[4-(1-pyridin-2-ylethylamino)phenoxy]acetamide
CID 43711075
3,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43195401
N-[(1R)-1-pyridin-2-ylethyl]hydroxylamine
CID 51441798
4-[3-(1-pyridin-2-ylethylamino)butyl]phenol
CID 43202604
propyl 4-(1-pyridin-2-ylethylamino)benzoate
CID 43139647
3-bromo-N-(1-pyridin-2-ylethyl)aniline
CID 43194583
3-bromo-4-fluoro-N-(1-pyridin-2-ylethyl)aniline
CID 113354964
N-[3-(1-pyridin-2-ylethylamino)phenyl]acetamide
CID 43193722

Frequently Asked Questions

What is the IUPAC name of 4-(1-pyridin-2-ylethylamino)phenol?
The IUPAC name of 4-(1-pyridin-2-ylethylamino)phenol (CID 43742707) is 4-(1-pyridin-2-ylethylamino)phenol.
What is the SMILES notation for 4-(1-pyridin-2-ylethylamino)phenol?
The canonical SMILES for 4-(1-pyridin-2-ylethylamino)phenol is CC(Nc1ccc(O)cc1)c1ccccn1.
What is the InChIKey of 4-(1-pyridin-2-ylethylamino)phenol?
The InChIKey is VHILKWTUWRGZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10(13-4-2-3-9-14-13)15-11-5-7-12(16)8-6-11/h2-10,15-16H,1H3.
What are the key properties of 4-(1-pyridin-2-ylethylamino)phenol?
4-(1-pyridin-2-ylethylamino)phenol has a molecular weight of 214.27 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-pyridin-2-ylethylamino)phenol is sourced from PubChem (CID 43742707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).