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

C23H19F2N3O2 — CID 154685929

IUPACN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide
SMILESCC(C)n1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccccc2F)o1
InChIInChI=1S/C23H19F2N3O2/c1-14(2)28-13-26-21(15-7-9-16(24)10-8-15)22(28)19-11-12-20(30-19)23(29)27-18-6-4-3-5-17(18)25/h3-14H,1-2H3,(H,27,29)
InChIKeySIABUCJHEMLWDM-UHFFFAOYSA-N
MW407.42 g/mol
LogP5.92
Rot. Bonds5

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

N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide (PubChem CID 154685929) has the molecular formula C23H19F2N3O2 and a molecular weight of 407.42 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide
PubChem CID154685929
Molecular FormulaC23H19F2N3O2
Molecular Weight407.42 g/mol
Exact Mass407.14
IUPAC NameN-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide
SMILESCC(C)n1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccccc2F)o1
InChIInChI=1S/C23H19F2N3O2/c1-14(2)28-13-26-21(15-7-9-16(24)10-8-15)22(28)19-11-12-20(30-19)23(29)27-18-6-4-3-5-17(18)25/h3-14H,1-2H3,(H,27,29)
InChIKeySIABUCJHEMLWDM-UHFFFAOYSA-N
XLogP5.92
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.42
LogP ≤ 55.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[1-Cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-YL]-N-(2-fluorophenyl)furan-2-carboxamide
CID 53036078
5-(1-cyclopentyl-4-(4-fluorophenyl)-1H-imidazol-5-yl)-N-(3-fluoropyridin-4-yl)furan-2-carboxamide
CID 154685874
N-(2-fluorophenyl)-5-(4-(4-fluorophenyl)-1-(pyrrolidin-3-yl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685899
5-(1-(cyclopentylmethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)-N-(2-fluorophenyl)furan-2-carboxamide
CID 154685918
N-(2-fluorophenyl)-5-(4-(4-fluorophenyl)-1-(pyrrolidin-3-ylmethyl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685919
N-(2-fluorophenyl)-5-(4-(4-fluorophenyl)-1-((tetrahydrofuran-2-yl)methyl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685922
N-(2-fluorophenyl)-5-(4-(4-fluorophenyl)-1-(tetrahydrofuran-3-yl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685961
5-(1-cyclopropyl-4-(4-fluorophenyl)-1H-imidazol-5-yl)-N-(2-fluorophenyl)furan-2-carboxamide
CID 154685964
N-(2-fluorophenyl)-5-(4-(4-fluorophenyl)-1-((tetrahydrofuran-3-yl)methyl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685971
N-(2-fluorophenyl)-5-4-(4-fluorophenyl)-1-(piperidin-4-yl)-1H-imidazol-5-yl)furan-2-carboxamide
CID 154685972
Tnik&map4K4-IN-1
CID 155069016
5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-N-[4-(4-methylpiperazin-1-yl)phenyl]furan-2-carboxamide
CID 164938184

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide (CID 154685929) is N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide is CC(C)n1cnc(-c2ccc(F)cc2)c1-c1ccc(C(=O)Nc2ccccc2F)o1.
What is the InChIKey of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide?
The InChIKey is SIABUCJHEMLWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F2N3O2/c1-14(2)28-13-26-21(15-7-9-16(24)10-8-15)22(28)19-11-12-20(30-19)23(29)27-18-6-4-3-5-17(18)25/h3-14H,1-2H3,(H,27,29).
What are the key properties of N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide?
N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide has a molecular weight of 407.42 g/mol, XLogP of 5.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-[5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]furan-2-carboxamide is sourced from PubChem (CID 154685929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).