2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide

C16H11Cl2F3N2O2 — CID 71239164

IUPAC2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESO=C(Cc1c(Cl)cc(Cl)cc1C(F)(F)F)NC1COc2ncccc21
InChIInChI=1S/C16H11Cl2F3N2O2/c17-8-4-11(16(19,20)21)10(12(18)5-8)6-14(24)23-13-7-25-15-9(13)2-1-3-22-15/h1-5,13H,6-7H2,(H,23,24)
InChIKeyCOYDGZDUROIEJH-UHFFFAOYSA-N
MW391.18 g/mol
LogP4.20
Rot. Bonds3

About 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide

2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (PubChem CID 71239164) has the molecular formula C16H11Cl2F3N2O2 and a molecular weight of 391.18 g/mol. Its IUPAC name is 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
PubChem CID71239164
Molecular FormulaC16H11Cl2F3N2O2
Molecular Weight391.18 g/mol
Exact Mass390.01
IUPAC Name2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESO=C(Cc1c(Cl)cc(Cl)cc1C(F)(F)F)NC1COc2ncccc21
InChIInChI=1S/C16H11Cl2F3N2O2/c17-8-4-11(16(19,20)21)10(12(18)5-8)6-14(24)23-13-7-25-15-9(13)2-1-3-22-15/h1-5,13H,6-7H2,(H,23,24)
InChIKeyCOYDGZDUROIEJH-UHFFFAOYSA-N
XLogP4.20
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.18
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The IUPAC name of 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (CID 71239164) is 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The canonical SMILES for 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is O=C(Cc1c(Cl)cc(Cl)cc1C(F)(F)F)NC1COc2ncccc21.
What is the InChIKey of 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The InChIKey is COYDGZDUROIEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2F3N2O2/c17-8-4-11(16(19,20)21)10(12(18)5-8)6-14(24)23-13-7-25-15-9(13)2-1-3-22-15/h1-5,13H,6-7H2,(H,23,24).
What are the key properties of 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide has a molecular weight of 391.18 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,4-dichloro-6-(trifluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is sourced from PubChem (CID 71239164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).