5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide

C17H18FNO2 — CID 123360801

IUPAC5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide
SMILESCC=c1oc(-c2ccc(F)cc2)c(C(=O)NC)c1=CCC
InChIInChI=1S/C17H18FNO2/c1-4-6-13-14(5-2)21-16(15(13)17(20)19-3)11-7-9-12(18)10-8-11/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyDTRLLZGZBDGEIY-UHFFFAOYSA-N
MW287.33 g/mol
LogP2.44
Rot. Bonds3

About 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide

5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide (PubChem CID 123360801) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide.

Molecular Properties

Compound Name5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide
PubChem CID123360801
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide
SMILESCC=c1oc(-c2ccc(F)cc2)c(C(=O)NC)c1=CCC
InChIInChI=1S/C17H18FNO2/c1-4-6-13-14(5-2)21-16(15(13)17(20)19-3)11-7-9-12(18)10-8-11/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyDTRLLZGZBDGEIY-UHFFFAOYSA-N
XLogP2.44
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide?
The IUPAC name of 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide (CID 123360801) is 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide.
What is the SMILES notation for 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide?
The canonical SMILES for 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide is CC=c1oc(-c2ccc(F)cc2)c(C(=O)NC)c1=CCC.
What is the InChIKey of 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide?
The InChIKey is DTRLLZGZBDGEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-4-6-13-14(5-2)21-16(15(13)17(20)19-3)11-7-9-12(18)10-8-11/h5-10H,4H2,1-3H3,(H,19,20).
What are the key properties of 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide?
5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide has a molecular weight of 287.33 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylidene-2-(4-fluorophenyl)-N-methyl-4-propylidenefuran-3-carboxamide is sourced from PubChem (CID 123360801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).