N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide

C24H20F2N4O2 — CID 154685899

IUPACN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCNC2)o1
InChIInChI=1S/C24H20F2N4O2/c25-16-7-5-15(6-8-16)22-23(30(14-28-22)17-11-12-27-13-17)20-9-10-21(32-20)24(31)29-19-4-2-1-3-18(19)26/h1-10,14,17,27H,11-13H2,(H,29,31)
InChIKeyBCDOLRDCUOQYMK-UHFFFAOYSA-N
MW434.45 g/mol
LogP4.88
Rot. Bonds5

About N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide

N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide (PubChem CID 154685899) has the molecular formula C24H20F2N4O2 and a molecular weight of 434.45 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide
PubChem CID154685899
Molecular FormulaC24H20F2N4O2
Molecular Weight434.45 g/mol
Exact Mass434.16
IUPAC NameN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCNC2)o1
InChIInChI=1S/C24H20F2N4O2/c25-16-7-5-15(6-8-16)22-23(30(14-28-22)17-11-12-27-13-17)20-9-10-21(32-20)24(31)29-19-4-2-1-3-18(19)26/h1-10,14,17,27H,11-13H2,(H,29,31)
InChIKeyBCDOLRDCUOQYMK-UHFFFAOYSA-N
XLogP4.88
TPSA72.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.45
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide (CID 154685899) is N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide is O=C(Nc1ccccc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCNC2)o1.
What is the InChIKey of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide?
The InChIKey is BCDOLRDCUOQYMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F2N4O2/c25-16-7-5-15(6-8-16)22-23(30(14-28-22)17-11-12-27-13-17)20-9-10-21(32-20)24(31)29-19-4-2-1-3-18(19)26/h1-10,14,17,27H,11-13H2,(H,29,31).
What are the key properties of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide?
N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide has a molecular weight of 434.45 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-pyrrolidin-3-ylimidazol-4-yl]furan-2-carboxamide is sourced from PubChem (CID 154685899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).