2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol

C14H15FN2O — CID 114833119

IUPAC2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1cccnc1N
InChIInChI=1S/C14H15FN2O/c1-14(18,12-3-2-8-17-13(12)16)9-10-4-6-11(15)7-5-10/h2-8,18H,9H2,1H3,(H2,16,17)
InChIKeyAHSPMLPXMBMQEJ-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.25
Rot. Bonds3

About 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol

2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol (PubChem CID 114833119) has the molecular formula C14H15FN2O and a molecular weight of 246.29 g/mol. Its IUPAC name is 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
PubChem CID114833119
Molecular FormulaC14H15FN2O
Molecular Weight246.29 g/mol
Exact Mass246.12
IUPAC Name2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccc(F)cc1)c1cccnc1N
InChIInChI=1S/C14H15FN2O/c1-14(18,12-3-2-8-17-13(12)16)9-10-4-6-11(15)7-5-10/h2-8,18H,9H2,1H3,(H2,16,17)
InChIKeyAHSPMLPXMBMQEJ-UHFFFAOYSA-N
XLogP2.25
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 ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833173
1-(4-fluorophenyl)-2-(3-fluoro-4-pyridinyl)propan-2-ol
CID 114832951
1-(4-fluorophenyl)-2-phenylpropan-2-ol
CID 53329553
1-(4-fluorophenyl)-2-pyrimidin-2-ylpropan-2-amine
CID 165485022
1-(4-tert-butylphenyl)-2-(4-fluorophenyl)propan-2-ol
CID 65144980
1-(2-amino-3-pyridinyl)-1-(3-fluorophenyl)propan-1-ol
CID 114872419
2-[4-(4-fluorophenyl)-2,3,3-trimethylbutan-2-yl]pyridine
CID 155036452
2-(4-chloro-2-fluorophenyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833204
2,2-bis(2-amino-3-pyridinyl)propanoic acid
CID 169221732
1-(4-fluorophenyl)-2-thiophen-2-ylpropan-2-ol
CID 63220221
1-(4-fluorophenyl)-2,3-dimethylbutan-2-ol
CID 58481762
1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
CID 114833720

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The IUPAC name of 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol (CID 114833119) is 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol.
What is the SMILES notation for 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The canonical SMILES for 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol is CC(O)(Cc1ccc(F)cc1)c1cccnc1N.
What is the InChIKey of 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
The InChIKey is AHSPMLPXMBMQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-14(18,12-3-2-8-17-13(12)16)9-10-4-6-11(15)7-5-10/h2-8,18H,9H2,1H3,(H2,16,17).
What are the key properties of 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol?
2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol has a molecular weight of 246.29 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol is sourced from PubChem (CID 114833119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).