6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide

C24H18FN3O2 — CID 68550453

IUPAC6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccc(-c4ccccc4)c(F)c3)nc2)cn1
InChIInChI=1S/C24H18FN3O2/c1-30-23-12-9-19(15-27-23)28-24(29)18-8-11-22(26-14-18)17-7-10-20(21(25)13-17)16-5-3-2-4-6-16/h2-15H,1H3,(H,28,29)
InChIKeyFYZXDUDXQRRDLL-UHFFFAOYSA-N
MW399.43 g/mol
LogP5.21
Rot. Bonds5

About 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide

6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide (PubChem CID 68550453) has the molecular formula C24H18FN3O2 and a molecular weight of 399.43 g/mol. Its IUPAC name is 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
PubChem CID68550453
Molecular FormulaC24H18FN3O2
Molecular Weight399.43 g/mol
Exact Mass399.14
IUPAC Name6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(-c3ccc(-c4ccccc4)c(F)c3)nc2)cn1
InChIInChI=1S/C24H18FN3O2/c1-30-23-12-9-19(15-27-23)28-24(29)18-8-11-22(26-14-18)17-7-10-20(21(25)13-17)16-5-3-2-4-6-16/h2-15H,1H3,(H,28,29)
InChIKeyFYZXDUDXQRRDLL-UHFFFAOYSA-N
XLogP5.21
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.43
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide (CID 68550453) is 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide is COc1ccc(NC(=O)c2ccc(-c3ccc(-c4ccccc4)c(F)c3)nc2)cn1.
What is the InChIKey of 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
The InChIKey is FYZXDUDXQRRDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O2/c1-30-23-12-9-19(15-27-23)28-24(29)18-8-11-22(26-14-18)17-7-10-20(21(25)13-17)16-5-3-2-4-6-16/h2-15H,1H3,(H,28,29).
What are the key properties of 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide?
6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide has a molecular weight of 399.43 g/mol, XLogP of 5.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoro-4-phenylphenyl)-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 68550453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).