4-amino-2-(1-fluoroethyl)phenol

C8H10FNO — CID 143243715

IUPAC4-amino-2-(1-fluoroethyl)phenol
SMILESCC(F)c1cc(N)ccc1O
InChIInChI=1S/C8H10FNO/c1-5(9)7-4-6(10)2-3-8(7)11/h2-5,11H,10H2,1H3
InChIKeyPGHBHDZJOIVFOU-UHFFFAOYSA-N
MW155.17 g/mol
LogP2.00
Rot. Bonds1

About 4-amino-2-(1-fluoroethyl)phenol

4-amino-2-(1-fluoroethyl)phenol (PubChem CID 143243715) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 4-amino-2-(1-fluoroethyl)phenol.

Molecular Properties

Compound Name4-amino-2-(1-fluoroethyl)phenol
PubChem CID143243715
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name4-amino-2-(1-fluoroethyl)phenol
SMILESCC(F)c1cc(N)ccc1O
InChIInChI=1S/C8H10FNO/c1-5(9)7-4-6(10)2-3-8(7)11/h2-5,11H,10H2,1H3
InChIKeyPGHBHDZJOIVFOU-UHFFFAOYSA-N
XLogP2.00
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-2-[hydroxy(iodo)methyl]phenol
CID 70536065
4-amino-2-[(1R)-1-amino-2,2-dimethylpropyl]phenol
CID 130731224
4-(aminooxymethyl)-2-(1-fluoroethyl)phenol
CID 117280118
4-amino-2-(1-amino-2-methoxyethyl)phenol
CID 55294234
3-amino-3-[3-(1-fluoroethyl)-4-hydroxyphenyl]propanoic acid
CID 84691068
4-(1-aminocyclohexyl)-2-(1-fluoroethyl)phenol
CID 117347337
3-amino-2-[3-(1-fluoroethyl)-4-hydroxyphenyl]propanoic acid
CID 84691069
4-(1-aminoethyl)-2-(difluoromethyl)phenol
CID 84660904
4-amino-2-(2-methylpropyl)phenol
CID 56609860
4-fluoro-3-propan-2-ylaniline
CID 45090554
2-(1-fluoroethyl)-4-(isocyanatomethyl)phenol
CID 117284995
2-(2-amino-1-hydroxyethyl)-4-(1-fluoroethyl)phenol
CID 84668851

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(1-fluoroethyl)phenol?
The IUPAC name of 4-amino-2-(1-fluoroethyl)phenol (CID 143243715) is 4-amino-2-(1-fluoroethyl)phenol.
What is the SMILES notation for 4-amino-2-(1-fluoroethyl)phenol?
The canonical SMILES for 4-amino-2-(1-fluoroethyl)phenol is CC(F)c1cc(N)ccc1O.
What is the InChIKey of 4-amino-2-(1-fluoroethyl)phenol?
The InChIKey is PGHBHDZJOIVFOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO/c1-5(9)7-4-6(10)2-3-8(7)11/h2-5,11H,10H2,1H3.
What are the key properties of 4-amino-2-(1-fluoroethyl)phenol?
4-amino-2-(1-fluoroethyl)phenol has a molecular weight of 155.17 g/mol, XLogP of 2.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(1-fluoroethyl)phenol is sourced from PubChem (CID 143243715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).