4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid

C59H57F2N19O4S3 — CID 160877720

About 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid

4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid (PubChem CID 160877720) has the molecular formula C59H57F2N19O4S3 and a molecular weight of 1230.43 g/mol. Its IUPAC name is 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid.

Molecular Properties

• Compound Name: 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid
• PubChem CID: 160877720
• Molecular Formula: C59H57F2N19O4S3
• Molecular Weight: 1230.43 g/mol
• Exact Mass: 1229.40
• IUPAC Name: 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid
• SMILES: Cc1[nH]cnc1C1CC1.Cc1c(C2CC2)ncn1-c1ccnc(C(=O)Nc2csc(-c3nncn3C3CC3)c2)c1.Nc1csc(-c2nncn2C2CC2)c1.O=C(Nc1csc(-c2nncn2C2CC2)c1)c1cc(F)ccn1.O=C(O)c1cc(F)ccn1
• InChI: InChI=1S/C22H21N7OS.C15H12FN5OS.C9H10N4S.C7H10N2.C6H4FNO2/c1-13-20(14-2-3-14)24-11-28(13)17-6-7-23-18(9-17)22(30)26-15-8-19(31-10-15)21-27-25-12-29(21)16-4-5-16;16-9-3-4-17-12(5-9)15(22)19-10-6-13(23-7-10)14-20-18-8-21(14)11-1-2-11;10-6-3-8(14-4-6)9-12-11-5-13(9)7-1-2-7;1-5-7(6-2-3-6)9-4-8-5;7-4-1-2-8-5(3-4)6(9)10/h6-12,14,16H,2-5H2,1H3,(H,26,30);3-8,11H,1-2H2,(H,19,22);3-5,7H,1-2,10H2;4,6H,2-3H2,1H3,(H,8,9);1-3H,(H,9,10)
• InChIKey: SMPSQWCMAWSFLE-UHFFFAOYSA-N
• XLogP: 11.93
• TPSA: 298.82 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 22
• Rotatable Bonds: 14
• Heavy Atoms: 87
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1230.43
LogP ≤ 5	11.93
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid?

The IUPAC name of 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid (CID 160877720) is 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid.

What is the SMILES notation for 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid?

The canonical SMILES for 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid is Cc1[nH]cnc1C1CC1.Cc1c(C2CC2)ncn1-c1ccnc(C(=O)Nc2csc(-c3nncn3C3CC3)c2)c1.Nc1csc(-c2nncn2C2CC2)c1.O=C(Nc1csc(-c2nncn2C2CC2)c1)c1cc(F)ccn1.O=C(O)c1cc(F)ccn1.

What is the InChIKey of 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid?

The InChIKey is SMPSQWCMAWSFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N7OS.C15H12FN5OS.C9H10N4S.C7H10N2.C6H4FNO2/c1-13-20(14-2-3-14)24-11-28(13)17-6-7-23-18(9-17)22(30)26-15-8-19(31-10-15)21-27-25-12-29(21)16-4-5-16;16-9-3-4-17-12(5-9)15(22)19-10-6-13(23-7-10)14-20-18-8-21(14)11-1-2-11;10-6-3-8(14-4-6)9-12-11-5-13(9)7-1-2-7;1-5-7(6-2-3-6)9-4-8-5;7-4-1-2-8-5(3-4)6(9)10/h6-12,14,16H,2-5H2,1H3,(H,26,30);3-8,11H,1-2H2,(H,19,22);3-5,7H,1-2,10H2;4,6H,2-3H2,1H3,(H,8,9);1-3H,(H,9,10).

What are the key properties of 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid?

4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid has a molecular weight of 1230.43 g/mol, XLogP of 11.93, 14 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4-cyclopropyl-5-methyl-1H-imidazole;4-(4-cyclopropyl-5-methylimidazol-1-yl)-N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]pyridine-2-carboxamide;5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-amine;N-[5-(4-cyclopropyl-1,2,4-triazol-3-yl)thiophen-3-yl]-4-fluoropyridine-2-carboxamide;4-fluoropyridine-2-carboxylic acid is sourced from PubChem (CID 160877720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).