2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol

C8H11FN2O2 — CID 162439847

IUPAC2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol
SMILESCC(CO)Oc1cc(N)c(F)cn1
InChIInChI=1S/C8H11FN2O2/c1-5(4-12)13-8-2-7(10)6(9)3-11-8/h2-3,5,12H,4H2,1H3,(H2,10,11)
InChIKeyYULIOTVCSWOWKP-UHFFFAOYSA-N
MW186.19 g/mol
LogP0.56
Rot. Bonds3

About 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol

2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol (PubChem CID 162439847) has the molecular formula C8H11FN2O2 and a molecular weight of 186.19 g/mol. Its IUPAC name is 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol.

Molecular Properties

Compound Name2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol
PubChem CID162439847
Molecular FormulaC8H11FN2O2
Molecular Weight186.19 g/mol
Exact Mass186.08
IUPAC Name2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol
SMILESCC(CO)Oc1cc(N)c(F)cn1
InChIInChI=1S/C8H11FN2O2/c1-5(4-12)13-8-2-7(10)6(9)3-11-8/h2-3,5,12H,4H2,1H3,(H2,10,11)
InChIKeyYULIOTVCSWOWKP-UHFFFAOYSA-N
XLogP0.56
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.19
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-5-fluoropyridin-4-amine
CID 155709241
(2R)-2-(2-fluoro-4-methylphenoxy)propan-1-ol
CID 90121366
(2S)-2-[[3-[4-(2-aminopyrimidin-5-yl)-3-fluorophenyl]-2-pyridinyl]oxy]propan-1-ol;sulfane
CID 162151654
(2S)-2-(5-bromo-2-fluorophenoxy)propan-1-ol
CID 163228830
5-bromo-4-fluoro-2-propan-2-yloxypyridine
CID 167451222
(5-chloro-2-pentan-2-yloxy-4-pyridinyl)methanol
CID 102982999
2-[2-(difluoromethoxy)-5-fluoro-4-pyridinyl]acetic acid
CID 131870546
2-[(4-amino-5-methyl-2-pyridinyl)oxy]ethanol
CID 83266577
4-amino-2-[(2S)-1-hydroxypropan-2-yl]oxyphenol
CID 89102627
2-(3-aminophenoxy)propan-1-ol
CID 130503390
5-pentan-2-yloxypyrazin-2-amine
CID 102988499
4-amino-5-fluoropyridine-2-carboxylic acid
CID 121230968

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol?
The IUPAC name of 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol (CID 162439847) is 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol.
What is the SMILES notation for 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol?
The canonical SMILES for 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol is CC(CO)Oc1cc(N)c(F)cn1.
What is the InChIKey of 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol?
The InChIKey is YULIOTVCSWOWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O2/c1-5(4-12)13-8-2-7(10)6(9)3-11-8/h2-3,5,12H,4H2,1H3,(H2,10,11).
What are the key properties of 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol?
2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol has a molecular weight of 186.19 g/mol, XLogP of 0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-5-fluoro-2-pyridinyl)oxy]propan-1-ol is sourced from PubChem (CID 162439847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).