N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride

C72H105ClF4N14O12 — CID 159136925

About N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride

N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride (PubChem CID 159136925) has the molecular formula C72H105ClF4N14O12 and a molecular weight of 1470.16 g/mol. Its IUPAC name is N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride.

Molecular Properties

• Compound Name: N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride
• PubChem CID: 159136925
• Molecular Formula: C72H105ClF4N14O12
• Molecular Weight: 1470.16 g/mol
• Exact Mass: 1468.77
• IUPAC Name: N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride
• SMILES: CC(C)c1nnc(C2CCC(C(=O)CCCNC(=O)c3cn(-c4ccccc4F)nc3C(F)(F)F)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)NCCCC(=O)OC(C)(C)C)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)NCCN)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)O)CC2)o1.Cl
• InChI: InChI=1S/C26H29F4N5O3.C20H33N3O4.C14H24N4O2.C12H18N2O3.ClH/c1-15(2)24-32-33-25(38-24)17-11-9-16(10-12-17)21(36)8-5-13-31-23(37)18-14-35(34-22(18)26(28,29)30)20-7-4-3-6-19(20)27;1-13(2)18-22-23-19(26-18)15-10-8-14(9-11-15)17(25)21-12-6-7-16(24)27-20(3,4)5;1-9(2)13-17-18-14(20-13)11-5-3-10(4-6-11)12(19)16-8-7-15;1-7(2)10-13-14-11(17-10)8-3-5-9(6-4-8)12(15)16;/h3-4,6-7,14-17H,5,8-13H2,1-2H3,(H,31,37);13-15H,6-12H2,1-5H3,(H,21,25);9-11H,3-8,15H2,1-2H3,(H,16,19);7-9H,3-6H2,1-2H3,(H,15,16);1H
• InChIKey: BYWGRVOUGCAUOF-UHFFFAOYSA-N
• XLogP: 13.81
• TPSA: 367.49 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 22
• Rotatable Bonds: 24
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1470.16
LogP ≤ 5	13.81
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride?

The IUPAC name of N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride (CID 159136925) is N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride.

What is the SMILES notation for N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride?

The canonical SMILES for N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride is CC(C)c1nnc(C2CCC(C(=O)CCCNC(=O)c3cn(-c4ccccc4F)nc3C(F)(F)F)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)NCCCC(=O)OC(C)(C)C)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)NCCN)CC2)o1.CC(C)c1nnc(C2CCC(C(=O)O)CC2)o1.Cl.

What is the InChIKey of N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride?

The InChIKey is BYWGRVOUGCAUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29F4N5O3.C20H33N3O4.C14H24N4O2.C12H18N2O3.ClH/c1-15(2)24-32-33-25(38-24)17-11-9-16(10-12-17)21(36)8-5-13-31-23(37)18-14-35(34-22(18)26(28,29)30)20-7-4-3-6-19(20)27;1-13(2)18-22-23-19(26-18)15-10-8-14(9-11-15)17(25)21-12-6-7-16(24)27-20(3,4)5;1-9(2)13-17-18-14(20-13)11-5-3-10(4-6-11)12(19)16-8-7-15;1-7(2)10-13-14-11(17-10)8-3-5-9(6-4-8)12(15)16;/h3-4,6-7,14-17H,5,8-13H2,1-2H3,(H,31,37);13-15H,6-12H2,1-5H3,(H,21,25);9-11H,3-8,15H2,1-2H3,(H,16,19);7-9H,3-6H2,1-2H3,(H,15,16);1H.

What are the key properties of N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride?

N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride has a molecular weight of 1470.16 g/mol, XLogP of 13.81, 24 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminoethyl)-4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxamide;tert-butyl 4-[[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexanecarbonyl]amino]butanoate;1-(2-fluorophenyl)-N-[4-oxo-4-[4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexyl]butyl]-3-(trifluoromethyl)pyrazole-4-carboxamide;4-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)cyclohexane-1-carboxylic acid;hydrochloride is sourced from PubChem (CID 159136925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).