2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide

C16H13ClF2N2O2 — CID 71239208

IUPAC2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESO=C(Cc1cccc(C(F)F)c1Cl)NC1COc2ncccc21
InChIInChI=1S/C16H13ClF2N2O2/c17-14-9(3-1-4-11(14)15(18)19)7-13(22)21-12-8-23-16-10(12)5-2-6-20-16/h1-6,12,15H,7-8H2,(H,21,22)
InChIKeySOLNYOJAUKFNLE-UHFFFAOYSA-N
MW338.74 g/mol
LogP3.46
Rot. Bonds4

About 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide

2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (PubChem CID 71239208) has the molecular formula C16H13ClF2N2O2 and a molecular weight of 338.74 g/mol. Its IUPAC name is 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
PubChem CID71239208
Molecular FormulaC16H13ClF2N2O2
Molecular Weight338.74 g/mol
Exact Mass338.06
IUPAC Name2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESO=C(Cc1cccc(C(F)F)c1Cl)NC1COc2ncccc21
InChIInChI=1S/C16H13ClF2N2O2/c17-14-9(3-1-4-11(14)15(18)19)7-13(22)21-12-8-23-16-10(12)5-2-6-20-16/h1-6,12,15H,7-8H2,(H,21,22)
InChIKeySOLNYOJAUKFNLE-UHFFFAOYSA-N
XLogP3.46
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.74
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The IUPAC name of 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (CID 71239208) is 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The canonical SMILES for 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is O=C(Cc1cccc(C(F)F)c1Cl)NC1COc2ncccc21.
What is the InChIKey of 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The InChIKey is SOLNYOJAUKFNLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClF2N2O2/c17-14-9(3-1-4-11(14)15(18)19)7-13(22)21-12-8-23-16-10(12)5-2-6-20-16/h1-6,12,15H,7-8H2,(H,21,22).
What are the key properties of 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide has a molecular weight of 338.74 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-3-(difluoromethyl)phenyl]-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is sourced from PubChem (CID 71239208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).