(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate

C15H11Cl2FN2O3 — CID 118588878

IUPAC(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate
SMILESO=C(NCc1cccc(Cl)c1Cl)OC1(F)COc2ncccc21
InChIInChI=1S/C15H11Cl2FN2O3/c16-11-5-1-3-9(12(11)17)7-20-14(21)23-15(18)8-22-13-10(15)4-2-6-19-13/h1-6H,7-8H2,(H,20,21)
InChIKeyLLJFNBGMNZCRPA-UHFFFAOYSA-N
MW357.17 g/mol
LogP3.83
Rot. Bonds3

About (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate

(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate (PubChem CID 118588878) has the molecular formula C15H11Cl2FN2O3 and a molecular weight of 357.17 g/mol. Its IUPAC name is (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate.

Molecular Properties

Compound Name(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate
PubChem CID118588878
Molecular FormulaC15H11Cl2FN2O3
Molecular Weight357.17 g/mol
Exact Mass356.01
IUPAC Name(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate
SMILESO=C(NCc1cccc(Cl)c1Cl)OC1(F)COc2ncccc21
InChIInChI=1S/C15H11Cl2FN2O3/c16-11-5-1-3-9(12(11)17)7-20-14(21)23-15(18)8-22-13-10(15)4-2-6-19-13/h1-6H,7-8H2,(H,20,21)
InChIKeyLLJFNBGMNZCRPA-UHFFFAOYSA-N
XLogP3.83
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.17
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate?
The IUPAC name of (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate (CID 118588878) is (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate.
What is the SMILES notation for (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate?
The canonical SMILES for (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate is O=C(NCc1cccc(Cl)c1Cl)OC1(F)COc2ncccc21.
What is the InChIKey of (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate?
The InChIKey is LLJFNBGMNZCRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2FN2O3/c16-11-5-1-3-9(12(11)17)7-20-14(21)23-15(18)8-22-13-10(15)4-2-6-19-13/h1-6H,7-8H2,(H,20,21).
What are the key properties of (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate?
(3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate has a molecular weight of 357.17 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2H-furo[2,3-b]pyridin-3-yl) N-[(2,3-dichlorophenyl)methyl]carbamate is sourced from PubChem (CID 118588878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).