N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide

C102H84ClF11N12O9 — CID 157241867

IUPACN-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(Cl)cc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(F)c(F)c1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1
InChIInChI=1S/C26H21F4N3O3.C26H23F2N3O2.C25H20ClF2N3O2.C25H20F3N3O2/c27-17-7-5-16(6-8-17)23-24(33(15-31-23)19-3-1-2-4-19)21-13-14-22(35-21)25(34)32-18-9-11-20(12-10-18)36-26(28,29)30;1-16-14-19(28)10-11-21(16)30-26(32)23-13-12-22(33-23)25-24(17-6-8-18(27)9-7-17)29-15-31(25)20-4-2-3-5-20;26-16-7-10-20(19(28)13-16)30-25(32)22-12-11-21(33-22)24-23(15-5-8-17(27)9-6-15)29-14-31(24)18-3-1-2-4-18;26-16-7-5-15(6-8-16)23-24(31(14-29-23)18-3-1-2-4-18)21-11-12-22(33-21)25(32)30-17-9-10-19(27)20(28)13-17/h5-15,19H,1-4H2,(H,32,34);6-15,20H,2-5H2,1H3,(H,30,32);2*5-14,18H,1-4H2,(H,30,32)
InChIKeyAVHROKOABUMJKO-UHFFFAOYSA-N
MW1866.30 g/mol
LogP27.68
Rot. Bonds21

About N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide

N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide (PubChem CID 157241867) has the molecular formula C102H84ClF11N12O9 and a molecular weight of 1866.30 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide
PubChem CID157241867
Molecular FormulaC102H84ClF11N12O9
Molecular Weight1866.30 g/mol
Exact Mass1864.60
IUPAC NameN-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide
SMILESCc1cc(F)ccc1NC(=O)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(Cl)cc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(F)c(F)c1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1
InChIInChI=1S/C26H21F4N3O3.C26H23F2N3O2.C25H20ClF2N3O2.C25H20F3N3O2/c27-17-7-5-16(6-8-17)23-24(33(15-31-23)19-3-1-2-4-19)21-13-14-22(35-21)25(34)32-18-9-11-20(12-10-18)36-26(28,29)30;1-16-14-19(28)10-11-21(16)30-26(32)23-13-12-22(33-23)25-24(17-6-8-18(27)9-7-17)29-15-31(25)20-4-2-3-5-20;26-16-7-10-20(19(28)13-16)30-25(32)22-12-11-21(33-22)24-23(15-5-8-17(27)9-6-15)29-14-31(24)18-3-1-2-4-18;26-16-7-5-15(6-8-16)23-24(31(14-29-23)18-3-1-2-4-18)21-11-12-22(33-21)25(32)30-17-9-10-19(27)20(28)13-17/h5-15,19H,1-4H2,(H,32,34);6-15,20H,2-5H2,1H3,(H,30,32);2*5-14,18H,1-4H2,(H,30,32)
InChIKeyAVHROKOABUMJKO-UHFFFAOYSA-N
XLogP27.68
TPSA249.47 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds21
Heavy Atoms135
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001866.30
LogP ≤ 527.68
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide (CID 157241867) is N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide is Cc1cc(F)ccc1NC(=O)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(Cl)cc1F)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(F)c(F)c1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.O=C(Nc1ccc(OC(F)(F)F)cc1)c1ccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCC2)o1.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide?
The InChIKey is AVHROKOABUMJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21F4N3O3.C26H23F2N3O2.C25H20ClF2N3O2.C25H20F3N3O2/c27-17-7-5-16(6-8-17)23-24(33(15-31-23)19-3-1-2-4-19)21-13-14-22(35-21)25(34)32-18-9-11-20(12-10-18)36-26(28,29)30;1-16-14-19(28)10-11-21(16)30-26(32)23-13-12-22(33-23)25-24(17-6-8-18(27)9-7-17)29-15-31(25)20-4-2-3-5-20;26-16-7-10-20(19(28)13-16)30-25(32)22-12-11-21(33-22)24-23(15-5-8-17(27)9-6-15)29-14-31(24)18-3-1-2-4-18;26-16-7-5-15(6-8-16)23-24(31(14-29-23)18-3-1-2-4-18)21-11-12-22(33-21)25(32)30-17-9-10-19(27)20(28)13-17/h5-15,19H,1-4H2,(H,32,34);6-15,20H,2-5H2,1H3,(H,30,32);2*5-14,18H,1-4H2,(H,30,32).
What are the key properties of N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide?
N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide has a molecular weight of 1866.30 g/mol, XLogP of 27.68, 21 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)-5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3,4-difluorophenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-fluoro-2-methylphenyl)furan-2-carboxamide;5-[3-cyclopentyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]furan-2-carboxamide is sourced from PubChem (CID 157241867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).