2-(2-aminopropyl)-5-fluorophenol

C9H12FNO — CID 83695312

IUPAC2-(2-aminopropyl)-5-fluorophenol
SMILESCC(N)Cc1ccc(F)cc1O
InChIInChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)5-9(7)12/h2-3,5-6,12H,4,11H2,1H3
InChIKeyAGWDMVKXMUNZHP-UHFFFAOYSA-N
MW169.20 g/mol
LogP1.42
Rot. Bonds2

About 2-(2-aminopropyl)-5-fluorophenol

2-(2-aminopropyl)-5-fluorophenol (PubChem CID 83695312) has the molecular formula C9H12FNO and a molecular weight of 169.20 g/mol. Its IUPAC name is 2-(2-aminopropyl)-5-fluorophenol.

Molecular Properties

Compound Name2-(2-aminopropyl)-5-fluorophenol
PubChem CID83695312
Molecular FormulaC9H12FNO
Molecular Weight169.20 g/mol
Exact Mass169.09
IUPAC Name2-(2-aminopropyl)-5-fluorophenol
SMILESCC(N)Cc1ccc(F)cc1O
InChIInChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)5-9(7)12/h2-3,5-6,12H,4,11H2,1H3
InChIKeyAGWDMVKXMUNZHP-UHFFFAOYSA-N
XLogP1.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)propan-2-amine;hydrochloride
CID 155973682
1-(2-chloro-4-fluorophenyl)propan-2-amine
CID 62600100
2-(2-aminopropyl)-5-chlorophenol
CID 83697150
(2S)-1-(2-bromo-5-fluorophenyl)propan-2-amine
CID 71270516
1-[5-fluoro-2-(2,2,2-trifluoroethyl)phenyl]propan-2-amine
CID 147165648
1-[4-fluoro-2-(methoxymethyl)phenyl]propan-2-amine
CID 117287117
4-(2-aminopropyl)-2-bromo-3-fluorophenol
CID 117372695
1-(2,4-difluorophenyl)propane-2-sulfonamide
CID 172765105
1-(2-ethoxy-5-fluorophenyl)propan-2-amine
CID 55254144
2-(2-aminopropyl)-4-chloro-5-fluorophenol
CID 117292217
4-(2-aminopropyl)-5-fluoro-2-methylphenol
CID 117279524
1-[4-(4-fluorophenoxy)-2-methylphenyl]propan-2-amine
CID 63801756

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropyl)-5-fluorophenol?
The IUPAC name of 2-(2-aminopropyl)-5-fluorophenol (CID 83695312) is 2-(2-aminopropyl)-5-fluorophenol.
What is the SMILES notation for 2-(2-aminopropyl)-5-fluorophenol?
The canonical SMILES for 2-(2-aminopropyl)-5-fluorophenol is CC(N)Cc1ccc(F)cc1O.
What is the InChIKey of 2-(2-aminopropyl)-5-fluorophenol?
The InChIKey is AGWDMVKXMUNZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FNO/c1-6(11)4-7-2-3-8(10)5-9(7)12/h2-3,5-6,12H,4,11H2,1H3.
What are the key properties of 2-(2-aminopropyl)-5-fluorophenol?
2-(2-aminopropyl)-5-fluorophenol has a molecular weight of 169.20 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropyl)-5-fluorophenol is sourced from PubChem (CID 83695312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).