5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole

C24H26F20N24 — CID 157429486

About 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole

5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole (PubChem CID 157429486) has the molecular formula C24H26F20N24 and a molecular weight of 1030.60 g/mol. Its IUPAC name is 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole.

Molecular Properties

• Compound Name: 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole
• PubChem CID: 157429486
• Molecular Formula: C24H26F20N24
• Molecular Weight: 1030.60 g/mol
• Exact Mass: 1030.25
• IUPAC Name: 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole
• SMILES: Cn1nnc(C(F)(F)C(F)(F)F)n1.Cn1nnc(C(F)(F)CC(F)(F)F)n1.Cn1nnc(C(F)(F)F)n1.Cn1nnc(C2CC2)n1.Cn1nnnc1C(F)(F)C(F)(F)F.Cn1nnnc1C(F)F
• InChI: InChI=1S/C5H5F5N4.C5H8N4.2C4H3F5N4.C3H3F3N4.C3H4F2N4/c1-14-12-3(11-13-14)4(6,7)2-5(8,9)10;1-9-7-5(6-8-9)4-2-3-4;1-13-2(10-11-12-13)3(5,6)4(7,8)9;1-13-11-2(10-12-13)3(5,6)4(7,8)9;1-10-8-2(7-9-10)3(4,5)6;1-9-3(2(4)5)6-7-8-9/h2H2,1H3;4H,2-3H2,1H3;2*1H3;1H3;2H,1H3
• InChIKey: BQJAMPCPLZAENB-UHFFFAOYSA-N
• XLogP: 3.45
• TPSA: 261.60 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 6
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1030.60
LogP ≤ 5	3.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole?

The IUPAC name of 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole (CID 157429486) is 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole.

What is the SMILES notation for 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole?

The canonical SMILES for 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole is Cn1nnc(C(F)(F)C(F)(F)F)n1.Cn1nnc(C(F)(F)CC(F)(F)F)n1.Cn1nnc(C(F)(F)F)n1.Cn1nnc(C2CC2)n1.Cn1nnnc1C(F)(F)C(F)(F)F.Cn1nnnc1C(F)F.

What is the InChIKey of 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole?

The InChIKey is BQJAMPCPLZAENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F5N4.C5H8N4.2C4H3F5N4.C3H3F3N4.C3H4F2N4/c1-14-12-3(11-13-14)4(6,7)2-5(8,9)10;1-9-7-5(6-8-9)4-2-3-4;1-13-2(10-11-12-13)3(5,6)4(7,8)9;1-13-11-2(10-12-13)3(5,6)4(7,8)9;1-10-8-2(7-9-10)3(4,5)6;1-9-3(2(4)5)6-7-8-9/h2H2,1H3;4H,2-3H2,1H3;2*1H3;1H3;2H,1H3.

What are the key properties of 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole?

5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole has a molecular weight of 1030.60 g/mol, XLogP of 3.45, 6 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 5-cyclopropyl-2-methyltetrazole;5-(difluoromethyl)-1-methyltetrazole;1-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,2,2,2-pentafluoroethyl)tetrazole;2-methyl-5-(1,1,3,3,3-pentafluoropropyl)tetrazole;2-methyl-5-(trifluoromethyl)tetrazole is sourced from PubChem (CID 157429486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).