6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide

C15H14ClF2N3O2 — CID 154993465

IUPAC6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1nc(N)c(F)cc1C(=O)Nc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClF2N3O2/c1-7(2)23-15-8(6-11(18)13(19)21-15)14(22)20-12-9(16)4-3-5-10(12)17/h3-7H,1-2H3,(H2,19,21)(H,20,22)
InChIKeyVEHLLKUOLYQQMF-UHFFFAOYSA-N
MW341.75 g/mol
LogP3.63
Rot. Bonds4

About 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide

6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide (PubChem CID 154993465) has the molecular formula C15H14ClF2N3O2 and a molecular weight of 341.75 g/mol. Its IUPAC name is 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide
PubChem CID154993465
Molecular FormulaC15H14ClF2N3O2
Molecular Weight341.75 g/mol
Exact Mass341.07
IUPAC Name6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1nc(N)c(F)cc1C(=O)Nc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClF2N3O2/c1-7(2)23-15-8(6-11(18)13(19)21-15)14(22)20-12-9(16)4-3-5-10(12)17/h3-7H,1-2H3,(H2,19,21)(H,20,22)
InChIKeyVEHLLKUOLYQQMF-UHFFFAOYSA-N
XLogP3.63
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.75
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide (CID 154993465) is 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide is CC(C)Oc1nc(N)c(F)cc1C(=O)Nc1c(F)cccc1Cl.
What is the InChIKey of 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is VEHLLKUOLYQQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClF2N3O2/c1-7(2)23-15-8(6-11(18)13(19)21-15)14(22)20-12-9(16)4-3-5-10(12)17/h3-7H,1-2H3,(H2,19,21)(H,20,22).
What are the key properties of 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide?
6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 341.75 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-chloro-6-fluorophenyl)-5-fluoro-2-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 154993465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).