1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol

C14H15FN2O — CID 114872419

IUPAC1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol
SMILESCCC(O)(c1cccc(F)c1)c1cccnc1N
InChIInChI=1S/C14H15FN2O/c1-2-14(18,10-5-3-6-11(15)9-10)12-7-4-8-17-13(12)16/h3-9,18H,2H2,1H3,(H2,16,17)
InChIKeyYPYFONCNVYMMPA-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.45
Rot. Bonds3

About 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol

1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol (PubChem CID 114872419) has the molecular formula C14H15FN2O and a molecular weight of 246.29 g/mol. Its IUPAC name is 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol.

Molecular Properties

Compound Name1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol
PubChem CID114872419
Molecular FormulaC14H15FN2O
Molecular Weight246.29 g/mol
Exact Mass246.12
IUPAC Name1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol
SMILESCCC(O)(c1cccc(F)c1)c1cccnc1N
InChIInChI=1S/C14H15FN2O/c1-2-14(18,10-5-3-6-11(15)9-10)12-7-4-8-17-13(12)16/h3-9,18H,2H2,1H3,(H2,16,17)
InChIKeyYPYFONCNVYMMPA-UHFFFAOYSA-N
XLogP2.45
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluorophenyl)-1-pyrazin-2-ylpropan-1-ol
CID 114872383
1-(5-fluoro-2-methoxyphenyl)-1-(3-fluorophenyl)propan-1-ol
CID 114872327
1-(3-fluorophenyl)-1-[3-(trifluoromethyl)phenyl]propan-1-ol
CID 114872417
1-(4-ethylphenyl)-1-(3-fluorophenyl)propan-1-ol
CID 114872344
1-(3-fluorophenyl)-1-quinolin-8-ylethanol
CID 81216618
2-amino-1,1-bis(3-fluorophenyl)ethanol
CID 71663464
CID 59612023
CID 59612023
2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833119
1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
CID 114872384
1-(2,4-difluorophenyl)-1-phenylpropan-1-ol
CID 62800875
3-(3-fluorophenyl)-5-methylheptan-3-ol
CID 114872328
1-(4-bromo-1-methylpyrazol-5-yl)-1-(3-fluorophenyl)propan-1-ol
CID 114872490

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol?
The IUPAC name of 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol (CID 114872419) is 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol.
What is the SMILES notation for 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol?
The canonical SMILES for 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol is CCC(O)(c1cccc(F)c1)c1cccnc1N.
What is the InChIKey of 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol?
The InChIKey is YPYFONCNVYMMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-2-14(18,10-5-3-6-11(15)9-10)12-7-4-8-17-13(12)16/h3-9,18H,2H2,1H3,(H2,16,17).
What are the key properties of 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol?
1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol has a molecular weight of 246.29 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol is sourced from PubChem (CID 114872419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).