3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol

C14H14F2N2O — CID 80523241

IUPAC3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol
SMILESNCC(c1cccnc1)C(O)c1cc(F)ccc1F
InChIInChI=1S/C14H14F2N2O/c15-10-3-4-13(16)11(6-10)14(19)12(7-17)9-2-1-5-18-8-9/h1-6,8,12,14,19H,7,17H2
InChIKeyLXEOSVJPOQBMEG-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.14
Rot. Bonds4

About 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol

3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol (PubChem CID 80523241) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol
PubChem CID80523241
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol
SMILESNCC(c1cccnc1)C(O)c1cc(F)ccc1F
InChIInChI=1S/C14H14F2N2O/c15-10-3-4-13(16)11(6-10)14(19)12(7-17)9-2-1-5-18-8-9/h1-6,8,12,14,19H,7,17H2
InChIKeyLXEOSVJPOQBMEG-UHFFFAOYSA-N
XLogP2.14
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-1-(2-chlorophenyl)-2-pyridin-3-ylpropan-1-ol
CID 80523261
3-amino-1-(3-chloro-2-fluorophenyl)-2-pyridin-3-ylpropan-1-ol
CID 81262776
3-amino-2-pyridin-3-yl-1-[2-(trifluoromethyl)phenyl]propan-1-ol
CID 80522600
3-amino-1-(2,5-difluorophenyl)-2-thiophen-2-ylpropan-1-ol
CID 65190198
3-amino-1-pyridin-3-yl-2-pyridin-4-ylpropan-1-ol
CID 80525679
3-amino-2-(3-chlorophenyl)-1-(2,4-difluorophenyl)propan-1-ol
CID 65186275
3-amino-1-(5-fluoro-2-methylphenyl)-2-phenylpropan-1-ol
CID 65186538
3-amino-1-pyridin-3-yl-2-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 65190750
(5-fluoro-2-methylphenyl)-pyridin-3-ylmethanol
CID 62388574
1-(2,5-difluorophenyl)-3-pyridin-3-ylpropan-1-ol
CID 105094895
3-amino-1-(2-bromo-5-fluorophenyl)-2-(3-chlorophenyl)propan-1-ol
CID 65186180
(5-chloro-2-fluorophenyl)-pyridin-3-ylmethanamine
CID 114885982

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol?
The IUPAC name of 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol (CID 80523241) is 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol.
What is the SMILES notation for 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol?
The canonical SMILES for 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol is NCC(c1cccnc1)C(O)c1cc(F)ccc1F.
What is the InChIKey of 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol?
The InChIKey is LXEOSVJPOQBMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c15-10-3-4-13(16)11(6-10)14(19)12(7-17)9-2-1-5-18-8-9/h1-6,8,12,14,19H,7,17H2.
What are the key properties of 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol?
3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol has a molecular weight of 264.28 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2,5-difluorophenyl)-2-pyridin-3-ylpropan-1-ol is sourced from PubChem (CID 80523241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).