3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide

C19H14F2N2O2 — CID 143032440

IUPAC3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide
SMILESO=C(NCc1cccc(F)c1)c1ccc(-c2ncccc2O)c(F)c1
InChIInChI=1S/C19H14F2N2O2/c20-14-4-1-3-12(9-14)11-23-19(25)13-6-7-15(16(21)10-13)18-17(24)5-2-8-22-18/h1-10,24H,11H2,(H,23,25)
InChIKeySZRLOZJNGVWQCX-UHFFFAOYSA-N
MW340.33 g/mol
LogP3.66
Rot. Bonds4

About 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide

3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide (PubChem CID 143032440) has the molecular formula C19H14F2N2O2 and a molecular weight of 340.33 g/mol. Its IUPAC name is 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide
PubChem CID143032440
Molecular FormulaC19H14F2N2O2
Molecular Weight340.33 g/mol
Exact Mass340.10
IUPAC Name3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide
SMILESO=C(NCc1cccc(F)c1)c1ccc(-c2ncccc2O)c(F)c1
InChIInChI=1S/C19H14F2N2O2/c20-14-4-1-3-12(9-14)11-23-19(25)13-6-7-15(16(21)10-13)18-17(24)5-2-8-22-18/h1-10,24H,11H2,(H,23,25)
InChIKeySZRLOZJNGVWQCX-UHFFFAOYSA-N
XLogP3.66
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.33
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide?
The IUPAC name of 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide (CID 143032440) is 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide.
What is the SMILES notation for 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide?
The canonical SMILES for 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide is O=C(NCc1cccc(F)c1)c1ccc(-c2ncccc2O)c(F)c1.
What is the InChIKey of 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide?
The InChIKey is SZRLOZJNGVWQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N2O2/c20-14-4-1-3-12(9-14)11-23-19(25)13-6-7-15(16(21)10-13)18-17(24)5-2-8-22-18/h1-10,24H,11H2,(H,23,25).
What are the key properties of 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide?
3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide has a molecular weight of 340.33 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide is sourced from PubChem (CID 143032440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).