3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide

C122H116F5N31O5 — CID 159098286

IUPAC3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide
SMILESCC(C)n1ccnc1-c1cccc(NC(=O)c2cccc(-n3cnc(C4CC4)c3)c2)n1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3C(C)C)n2)cc1-n1cnc(C2CC2)c1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3[C@@H](C)C(F)(F)F)n2)cc1-n1cnc(C2CC2)c1.Cc1ccc(C(=O)Nc2cccc(-c3nccn3C3CC3)n2)cc1-n1cnc(C2CC2)c1.O=C(Nc1cccc(-c2nncn2C2CC2)c1)c1cc(-n2cnc(C3CC3)c2)ccn1
InChIInChI=1S/C25H22F4N6O.C25H25FN6O.C25H24N6O.C24H24N6O.C23H21N7O/c1-14-10-18(26)17(11-21(14)34-12-20(31-13-34)16-6-7-16)24(36)33-22-5-3-4-19(32-22)23-30-8-9-35(23)15(2)25(27,28)29;1-15(2)32-10-9-27-24(32)20-5-4-6-23(29-20)30-25(33)18-12-22(16(3)11-19(18)26)31-13-21(28-14-31)17-7-8-17;1-16-5-6-18(13-22(16)30-14-21(27-15-30)17-7-8-17)25(32)29-23-4-2-3-20(28-23)24-26-11-12-31(24)19-9-10-19;1-16(2)30-12-11-25-23(30)20-7-4-8-22(27-20)28-24(31)18-5-3-6-19(13-18)29-14-21(26-15-29)17-9-10-17;31-23(20-11-19(8-9-24-20)29-12-21(25-13-29)15-4-5-15)27-17-3-1-2-16(10-17)22-28-26-14-30(22)18-6-7-18/h3-5,8-13,15-16H,6-7H2,1-2H3,(H,32,33,36);4-6,9-15,17H,7-8H2,1-3H3,(H,29,30,33);2-6,11-15,17,19H,7-10H2,1H3,(H,28,29,32);3-8,11-17H,9-10H2,1-2H3,(H,27,28,31);1-3,8-15,18H,4-7H2,(H,27,31)/t15-;;;;/m0..../s1
InChIKeyKCYJGASCXVJJIB-FWELSTJRSA-N
MW2191.47 g/mol
LogP24.86
Rot. Bonds30

About 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide

3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide (PubChem CID 159098286) has the molecular formula C122H116F5N31O5 and a molecular weight of 2191.47 g/mol. Its IUPAC name is 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide
PubChem CID159098286
Molecular FormulaC122H116F5N31O5
Molecular Weight2191.47 g/mol
Exact Mass2189.97
IUPAC Name3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide
SMILESCC(C)n1ccnc1-c1cccc(NC(=O)c2cccc(-n3cnc(C4CC4)c3)c2)n1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3C(C)C)n2)cc1-n1cnc(C2CC2)c1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3[C@@H](C)C(F)(F)F)n2)cc1-n1cnc(C2CC2)c1.Cc1ccc(C(=O)Nc2cccc(-c3nccn3C3CC3)n2)cc1-n1cnc(C2CC2)c1.O=C(Nc1cccc(-c2nncn2C2CC2)c1)c1cc(-n2cnc(C3CC3)c2)ccn1
InChIInChI=1S/C25H22F4N6O.C25H25FN6O.C25H24N6O.C24H24N6O.C23H21N7O/c1-14-10-18(26)17(11-21(14)34-12-20(31-13-34)16-6-7-16)24(36)33-22-5-3-4-19(32-22)23-30-8-9-35(23)15(2)25(27,28)29;1-15(2)32-10-9-27-24(32)20-5-4-6-23(29-20)30-25(33)18-12-22(16(3)11-19(18)26)31-13-21(28-14-31)17-7-8-17;1-16-5-6-18(13-22(16)30-14-21(27-15-30)17-7-8-17)25(32)29-23-4-2-3-20(28-23)24-26-11-12-31(24)19-9-10-19;1-16(2)30-12-11-25-23(30)20-7-4-8-22(27-20)28-24(31)18-5-3-6-19(13-18)29-14-21(26-15-29)17-9-10-17;31-23(20-11-19(8-9-24-20)29-12-21(25-13-29)15-4-5-15)27-17-3-1-2-16(10-17)22-28-26-14-30(22)18-6-7-18/h3-5,8-13,15-16H,6-7H2,1-2H3,(H,32,33,36);4-6,9-15,17H,7-8H2,1-3H3,(H,29,30,33);2-6,11-15,17,19H,7-10H2,1H3,(H,28,29,32);3-8,11-17H,9-10H2,1-2H3,(H,27,28,31);1-3,8-15,18H,4-7H2,(H,27,31)/t15-;;;;/m0..../s1
InChIKeyKCYJGASCXVJJIB-FWELSTJRSA-N
XLogP24.86
TPSA401.04 Ų
H-Bond Donors5
H-Bond Acceptors31
Rotatable Bonds30
Heavy Atoms163
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002191.47
LogP ≤ 524.86
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1031

Analyze 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide?
The IUPAC name of 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide (CID 159098286) is 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide is CC(C)n1ccnc1-c1cccc(NC(=O)c2cccc(-n3cnc(C4CC4)c3)c2)n1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3C(C)C)n2)cc1-n1cnc(C2CC2)c1.Cc1cc(F)c(C(=O)Nc2cccc(-c3nccn3[C@@H](C)C(F)(F)F)n2)cc1-n1cnc(C2CC2)c1.Cc1ccc(C(=O)Nc2cccc(-c3nccn3C3CC3)n2)cc1-n1cnc(C2CC2)c1.O=C(Nc1cccc(-c2nncn2C2CC2)c1)c1cc(-n2cnc(C3CC3)c2)ccn1.
What is the InChIKey of 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide?
The InChIKey is KCYJGASCXVJJIB-FWELSTJRSA-N. The full InChI is InChI=1S/C25H22F4N6O.C25H25FN6O.C25H24N6O.C24H24N6O.C23H21N7O/c1-14-10-18(26)17(11-21(14)34-12-20(31-13-34)16-6-7-16)24(36)33-22-5-3-4-19(32-22)23-30-8-9-35(23)15(2)25(27,28)29;1-15(2)32-10-9-27-24(32)20-5-4-6-23(29-20)30-25(33)18-12-22(16(3)11-19(18)26)31-13-21(28-14-31)17-7-8-17;1-16-5-6-18(13-22(16)30-14-21(27-15-30)17-7-8-17)25(32)29-23-4-2-3-20(28-23)24-26-11-12-31(24)19-9-10-19;1-16(2)30-12-11-25-23(30)20-7-4-8-22(27-20)28-24(31)18-5-3-6-19(13-18)29-14-21(26-15-29)17-9-10-17;31-23(20-11-19(8-9-24-20)29-12-21(25-13-29)15-4-5-15)27-17-3-1-2-16(10-17)22-28-26-14-30(22)18-6-7-18/h3-5,8-13,15-16H,6-7H2,1-2H3,(H,32,33,36);4-6,9-15,17H,7-8H2,1-3H3,(H,29,30,33);2-6,11-15,17,19H,7-10H2,1H3,(H,28,29,32);3-8,11-17H,9-10H2,1-2H3,(H,27,28,31);1-3,8-15,18H,4-7H2,(H,27,31)/t15-;;;;/m0..../s1.
What are the key properties of 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide?
3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide has a molecular weight of 2191.47 g/mol, XLogP of 24.86, 30 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-cyclopropylimidazol-2-yl)-2-pyridinyl]-4-methylbenzamide;4-(4-cyclopropylimidazol-1-yl)-N-[3-(4-cyclopropyl-1,2,4-triazol-3-yl)phenyl]pyridine-2-carboxamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide;5-(4-cyclopropylimidazol-1-yl)-2-fluoro-4-methyl-N-[6-[1-[(2S)-1,1,1-trifluoropropan-2-yl]imidazol-2-yl]-2-pyridinyl]benzamide;3-(4-cyclopropylimidazol-1-yl)-N-[6-(1-propan-2-ylimidazol-2-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 159098286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).