2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide

C19H16FN3O2 — CID 154311592

IUPAC2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
SMILESCc1nc(N)c(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1F
InChIInChI=1S/C19H16FN3O2/c1-12-17(20)11-16(18(21)22-12)19(24)23-13-7-9-15(10-8-13)25-14-5-3-2-4-6-14/h2-11H,1H3,(H2,21,22)(H,23,24)
InChIKeyFUSOEHRZELJMJT-UHFFFAOYSA-N
MW337.35 g/mol
LogP4.16
Rot. Bonds4

About 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide

2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide (PubChem CID 154311592) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
PubChem CID154311592
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
SMILESCc1nc(N)c(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1F
InChIInChI=1S/C19H16FN3O2/c1-12-17(20)11-16(18(21)22-12)19(24)23-13-7-9-15(10-8-13)25-14-5-3-2-4-6-14/h2-11H,1H3,(H2,21,22)(H,23,24)
InChIKeyFUSOEHRZELJMJT-UHFFFAOYSA-N
XLogP4.16
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide (CID 154311592) is 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide is Cc1nc(N)c(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1F.
What is the InChIKey of 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
The InChIKey is FUSOEHRZELJMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-12-17(20)11-16(18(21)22-12)19(24)23-13-7-9-15(10-8-13)25-14-5-3-2-4-6-14/h2-11H,1H3,(H2,21,22)(H,23,24).
What are the key properties of 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide?
2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide has a molecular weight of 337.35 g/mol, XLogP of 4.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-fluoro-6-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 154311592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).