2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol

C8H11FN2O — CID 55292830

IUPAC2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol
SMILESCC(N)(CO)c1cncc(F)c1
InChIInChI=1S/C8H11FN2O/c1-8(10,5-12)6-2-7(9)4-11-3-6/h2-4,12H,5,10H2,1H3
InChIKeyPXDWRKWJVDWJLB-UHFFFAOYSA-N
MW170.19 g/mol
LogP0.39
Rot. Bonds2

About 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol

2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol (PubChem CID 55292830) has the molecular formula C8H11FN2O and a molecular weight of 170.19 g/mol. Its IUPAC name is 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol
PubChem CID55292830
Molecular FormulaC8H11FN2O
Molecular Weight170.19 g/mol
Exact Mass170.09
IUPAC Name2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol
SMILESCC(N)(CO)c1cncc(F)c1
InChIInChI=1S/C8H11FN2O/c1-8(10,5-12)6-2-7(9)4-11-3-6/h2-4,12H,5,10H2,1H3
InChIKeyPXDWRKWJVDWJLB-UHFFFAOYSA-N
XLogP0.39
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.19
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol?
The IUPAC name of 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol (CID 55292830) is 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol.
What is the SMILES notation for 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol?
The canonical SMILES for 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol is CC(N)(CO)c1cncc(F)c1.
What is the InChIKey of 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol?
The InChIKey is PXDWRKWJVDWJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2O/c1-8(10,5-12)6-2-7(9)4-11-3-6/h2-4,12H,5,10H2,1H3.
What are the key properties of 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol?
2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol has a molecular weight of 170.19 g/mol, XLogP of 0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5-fluoro-3-pyridinyl)propan-1-ol is sourced from PubChem (CID 55292830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).