3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane

C147H240F13N15O9 — CID 158278460

About 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane

3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane (PubChem CID 158278460) has the molecular formula C147H240F13N15O9 and a molecular weight of 2608.61 g/mol. Its IUPAC name is 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane.

Molecular Properties

• Compound Name: 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane
• PubChem CID: 158278460
• Molecular Formula: C147H240F13N15O9
• Molecular Weight: 2608.61 g/mol
• Exact Mass: 2606.86
• IUPAC Name: 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane
• SMILES: CC(C)C(C)(F)F.CC(C)C(F)(F)F.CC(C)CCN1CCCCC1.CC(C)CCN1CCOCC1.CC(C)OC(F)(F)F.CC(C)OC(F)F.CC(C)c1ccc(C2CC2)nn1.CC(C)c1ccc(CCN2CCOCC2)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(N2CCOCC2)cc1.CC(C)c1cccc(F)c1.CC(C)c1ccccc1F.CC(C)c1cnc(C(C)(C)O)cn1.CCOc1ccc(C(C)C)nn1.CNC(=O)C(C)C.COCCC(C)C.Cc1ccc(C(C)C)nn1.Cc1nccc(C(C)C)n1
• InChI: InChI=1S/C15H23NO.C13H19NO.C10H16N2O.C10H14N2.C10H21N.3C9H11F.C9H14N2O.C9H19NO.2C8H12N2.C6H14O.C5H10F2.C5H11NO.C4H7F3O.C4H7F3.C4H8F2O/c1-13(2)15-5-3-14(4-6-15)7-8-16-9-11-17-12-10-16;1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14;1-7(2)8-5-12-9(6-11-8)10(3,4)13;1-7(2)9-5-6-10(12-11-9)8-3-4-8;1-10(2)6-9-11-7-4-3-5-8-11;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-4-3-5-9(10)6-8;1-7(2)8-5-3-4-6-9(8)10;1-4-12-9-6-5-8(7(2)3)10-11-9;1-9(2)3-4-10-5-7-11-8-6-10;1-6(2)8-4-5-9-7(3)10-8;1-6(2)8-5-4-7(3)9-10-8;1-6(2)4-5-7-3;1-4(2)5(3,6)7;1-4(2)5(7)6-3;1-3(2)8-4(5,6)7;1-3(2)4(5,6)7;1-3(2)7-4(5)6/h3-6,13H,7-12H2,1-2H3;3-6,11H,7-10H2,1-2H3;5-7,13H,1-4H3;5-8H,3-4H2,1-2H3;10H,3-9H2,1-2H3;3*3-7H,1-2H3;5-7H,4H2,1-3H3;9H,3-8H2,1-2H3;2*4-6H,1-3H3;6H,4-5H2,1-3H3;4H,1-3H3;4H,1-3H3,(H,6,7);3H,1-2H3;3H,1-2H3;3-4H,1-2H3
• InChIKey: GJXHIWRBJFQRTR-UHFFFAOYSA-N
• XLogP: 38.32
• TPSA: 255.80 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 23
• Rotatable Bonds: 32
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2608.61
LogP ≤ 5	38.32
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane?

The IUPAC name of 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane (CID 158278460) is 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane.

What is the SMILES notation for 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane?

The canonical SMILES for 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane is CC(C)C(C)(F)F.CC(C)C(F)(F)F.CC(C)CCN1CCCCC1.CC(C)CCN1CCOCC1.CC(C)OC(F)(F)F.CC(C)OC(F)F.CC(C)c1ccc(C2CC2)nn1.CC(C)c1ccc(CCN2CCOCC2)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(N2CCOCC2)cc1.CC(C)c1cccc(F)c1.CC(C)c1ccccc1F.CC(C)c1cnc(C(C)(C)O)cn1.CCOc1ccc(C(C)C)nn1.CNC(=O)C(C)C.COCCC(C)C.Cc1ccc(C(C)C)nn1.Cc1nccc(C(C)C)n1.

What is the InChIKey of 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane?

The InChIKey is GJXHIWRBJFQRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO.C13H19NO.C10H16N2O.C10H14N2.C10H21N.3C9H11F.C9H14N2O.C9H19NO.2C8H12N2.C6H14O.C5H10F2.C5H11NO.C4H7F3O.C4H7F3.C4H8F2O/c1-13(2)15-5-3-14(4-6-15)7-8-16-9-11-17-12-10-16;1-11(2)12-3-5-13(6-4-12)14-7-9-15-10-8-14;1-7(2)8-5-12-9(6-11-8)10(3,4)13;1-7(2)9-5-6-10(12-11-9)8-3-4-8;1-10(2)6-9-11-7-4-3-5-8-11;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-4-3-5-9(10)6-8;1-7(2)8-5-3-4-6-9(8)10;1-4-12-9-6-5-8(7(2)3)10-11-9;1-9(2)3-4-10-5-7-11-8-6-10;1-6(2)8-4-5-9-7(3)10-8;1-6(2)8-5-4-7(3)9-10-8;1-6(2)4-5-7-3;1-4(2)5(3,6)7;1-4(2)5(7)6-3;1-3(2)8-4(5,6)7;1-3(2)4(5,6)7;1-3(2)7-4(5)6/h3-6,13H,7-12H2,1-2H3;3-6,11H,7-10H2,1-2H3;5-7,13H,1-4H3;5-8H,3-4H2,1-2H3;10H,3-9H2,1-2H3;3*3-7H,1-2H3;5-7H,4H2,1-3H3;9H,3-8H2,1-2H3;2*4-6H,1-3H3;6H,4-5H2,1-3H3;4H,1-3H3;4H,1-3H3,(H,6,7);3H,1-2H3;3H,1-2H3;3-4H,1-2H3.

What are the key properties of 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane?

3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane has a molecular weight of 2608.61 g/mol, XLogP of 38.32, 32 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 3-cyclopropyl-6-propan-2-ylpyridazine;2-(difluoromethoxy)propane;2,2-difluoro-3-methylbutane;N,2-dimethylpropanamide;3-ethoxy-6-propan-2-ylpyridazine;1-fluoro-2-propan-2-ylbenzene;1-fluoro-3-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene;1-methoxy-3-methylbutane;4-(3-methylbutyl)morpholine;1-(3-methylbutyl)piperidine;3-methyl-6-propan-2-ylpyridazine;2-methyl-4-propan-2-ylpyrimidine;4-[2-(4-propan-2-ylphenyl)ethyl]morpholine;4-(4-propan-2-ylphenyl)morpholine;2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol;2-(trifluoromethoxy)propane;1,1,1-trifluoro-2-methylpropane is sourced from PubChem (CID 158278460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).