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

C16H14Cl2N2O2 — CID 71239153

IUPAC2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESCc1cc(Cl)cc(Cl)c1CC(=O)NC1COc2ncccc21
InChIInChI=1S/C16H14Cl2N2O2/c1-9-5-10(17)6-13(18)12(9)7-15(21)20-14-8-22-16-11(14)3-2-4-19-16/h2-6,14H,7-8H2,1H3,(H,20,21)
InChIKeyXITJMYCPOQRQTJ-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.49
Rot. Bonds3

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

2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (PubChem CID 71239153) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
PubChem CID71239153
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC Name2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide
SMILESCc1cc(Cl)cc(Cl)c1CC(=O)NC1COc2ncccc21
InChIInChI=1S/C16H14Cl2N2O2/c1-9-5-10(17)6-13(18)12(9)7-15(21)20-14-8-22-16-11(14)3-2-4-19-16/h2-6,14H,7-8H2,1H3,(H,20,21)
InChIKeyXITJMYCPOQRQTJ-UHFFFAOYSA-N
XLogP3.49
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 53.49
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-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The IUPAC name of 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide (CID 71239153) is 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The canonical SMILES for 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is Cc1cc(Cl)cc(Cl)c1CC(=O)NC1COc2ncccc21.
What is the InChIKey of 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
The InChIKey is XITJMYCPOQRQTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-9-5-10(17)6-13(18)12(9)7-15(21)20-14-8-22-16-11(14)3-2-4-19-16/h2-6,14H,7-8H2,1H3,(H,20,21).
What are the key properties of 2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide?
2-(2,4-dichloro-6-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide has a molecular weight of 337.21 g/mol, XLogP of 3.49, 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-methylphenyl)-N-(2,3-dihydrofuro[2,3-b]pyridin-3-yl)acetamide is sourced from PubChem (CID 71239153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).