2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide

C13H12FN3O2 — CID 68661151

IUPAC2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide
SMILESNC(=O)CNc1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C13H12FN3O2/c14-10-3-1-2-8(4-10)9-5-11(18)13(16-6-9)17-7-12(15)19/h1-6,18H,7H2,(H2,15,19)(H,16,17)
InChIKeyKYHWLLZAXAQMNW-UHFFFAOYSA-N
MW261.26 g/mol
LogP1.49
Rot. Bonds4

About 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide

2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide (PubChem CID 68661151) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide.

Molecular Properties

Compound Name2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide
PubChem CID68661151
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC Name2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide
SMILESNC(=O)CNc1ncc(-c2cccc(F)c2)cc1O
InChIInChI=1S/C13H12FN3O2/c14-10-3-1-2-8(4-10)9-5-11(18)13(16-6-9)17-7-12(15)19/h1-6,18H,7H2,(H2,15,19)(H,16,17)
InChIKeyKYHWLLZAXAQMNW-UHFFFAOYSA-N
XLogP1.49
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide?
The IUPAC name of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide (CID 68661151) is 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide.
What is the SMILES notation for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide?
The canonical SMILES for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide is NC(=O)CNc1ncc(-c2cccc(F)c2)cc1O.
What is the InChIKey of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide?
The InChIKey is KYHWLLZAXAQMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c14-10-3-1-2-8(4-10)9-5-11(18)13(16-6-9)17-7-12(15)19/h1-6,18H,7H2,(H2,15,19)(H,16,17).
What are the key properties of 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide?
2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide has a molecular weight of 261.26 g/mol, XLogP of 1.49, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(3-fluorophenyl)-3-hydroxy-2-pyridinyl]amino]acetamide is sourced from PubChem (CID 68661151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).