2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane

C178H381F5O2 — CID 158650941

About 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane

2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane (PubChem CID 158650941) has the molecular formula C178H381F5O2 and a molecular weight of 2648.99 g/mol. Its IUPAC name is 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane.

Molecular Properties

• Compound Name: 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane
• PubChem CID: 158650941
• Molecular Formula: C178H381F5O2
• Molecular Weight: 2648.99 g/mol
• Exact Mass: 2646.96
• IUPAC Name: 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane
• SMILES: C#CCC(C)C.C=CC1CC1(C)C.C=CCC(C)C.C=CCCC(C)C.C=CCCCC(C)C.CC(C)C.CC(C)C(C)C.CC(C)C(F)(F)F.CC(C)CC(C)C.CC(C)CC1CC1.CC(C)CCC(C)C.CC1(C)CC1C1CC1.CC1CC1(C)C.CCC(C)C.CCC(C)C(C)C.CCC(F)(F)C(C)C.CCC1CC1(C)C.CCCC(C)(C)C.CCCC(C)(C)CC.CCCC(C)(C)CCC.CCCC(C)C.CCCC(C)C.CCCCC(C)C.CCCCC(C)C.CCCCCC(C)C.COCC(C)C.COCCC(C)C
• InChI: InChI=1S/C9H20.C8H14.3C8H18.C8H16.2C7H14.C7H12.5C7H16.C7H14.C6H12F2.C6H14O.C6H12.3C6H14.C6H12.C6H10.C5H12O.C5H12.C4H7F3.C4H10/c1-5-7-9(3,4)8-6-2;1-8(2)5-7(8)6-3-4-6;1-7(2)5-6-8(3)4;1-5-7-8(3,4)6-2;2*1-4-5-6-7-8(2)3;1-6(2)5-7-3-4-7;2*1-4-6-5-7(6,2)3;1-6(2)5-7(3)4;1-5-6-7(2,3)4;1-5-7(4)6(2)3;3*1-4-5-6-7(2)3;1-4-6(7,8)5(2)3;1-6(2)4-5-7-3;1-5-4-6(5,2)3;1-5(2)6(3)4;4*1-4-5-6(2)3;1-5(2)4-6-3;1-4-5(2)3;1-3(2)4(5,6)7;1-4(2)3/h5-8H2,1-4H3;6-7H,3-5H2,1-2H3;7-8H,5-6H2,1-4H3;5-7H2,1-4H3;8H,4-7H2,1-3H3;4,8H,1,5-7H2,2-3H3;6-7H,3-5H2,1-2H3;6H,4-5H2,1-3H3;4,6H,1,5H2,2-3H3;6-7H,5H2,1-4H3;5-6H2,1-4H3;6-7H,5H2,1-4H3;2*7H,4-6H2,1-3H3;4,7H,1,5-6H2,2-3H3;5H,4H2,1-3H3;6H,4-5H2,1-3H3;5H,4H2,1-3H3;5-6H,1-4H3;2*6H,4-5H2,1-3H3;4,6H,1,5H2,2-3H3;1,6H,5H2,2-3H3;5H,4H2,1-3H3;5H,4H2,1-3H3;3H,1-2H3;4H,1-3H3
• InChIKey: IBNWHHZNNBGROH-UHFFFAOYSA-N
• XLogP: 66.86
• TPSA: 18.46 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 53
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2648.99
LogP ≤ 5	66.86
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane?

The IUPAC name of 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane (CID 158650941) is 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane.

What is the SMILES notation for 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane?

The canonical SMILES for 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane is C#CCC(C)C.C=CC1CC1(C)C.C=CCC(C)C.C=CCCC(C)C.C=CCCCC(C)C.CC(C)C.CC(C)C(C)C.CC(C)C(F)(F)F.CC(C)CC(C)C.CC(C)CC1CC1.CC(C)CCC(C)C.CC1(C)CC1C1CC1.CC1CC1(C)C.CCC(C)C.CCC(C)C(C)C.CCC(F)(F)C(C)C.CCC1CC1(C)C.CCCC(C)(C)C.CCCC(C)(C)CC.CCCC(C)(C)CCC.CCCC(C)C.CCCC(C)C.CCCCC(C)C.CCCCC(C)C.CCCCCC(C)C.COCC(C)C.COCCC(C)C.

What is the InChIKey of 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane?

The InChIKey is IBNWHHZNNBGROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20.C8H14.3C8H18.C8H16.2C7H14.C7H12.5C7H16.C7H14.C6H12F2.C6H14O.C6H12.3C6H14.C6H12.C6H10.C5H12O.C5H12.C4H7F3.C4H10/c1-5-7-9(3,4)8-6-2;1-8(2)5-7(8)6-3-4-6;1-7(2)5-6-8(3)4;1-5-7-8(3,4)6-2;2*1-4-5-6-7-8(2)3;1-6(2)5-7-3-4-7;2*1-4-6-5-7(6,2)3;1-6(2)5-7(3)4;1-5-6-7(2,3)4;1-5-7(4)6(2)3;3*1-4-5-6-7(2)3;1-4-6(7,8)5(2)3;1-6(2)4-5-7-3;1-5-4-6(5,2)3;1-5(2)6(3)4;4*1-4-5-6(2)3;1-5(2)4-6-3;1-4-5(2)3;1-3(2)4(5,6)7;1-4(2)3/h5-8H2,1-4H3;6-7H,3-5H2,1-2H3;7-8H,5-6H2,1-4H3;5-7H2,1-4H3;8H,4-7H2,1-3H3;4,8H,1,5-7H2,2-3H3;6-7H,3-5H2,1-2H3;6H,4-5H2,1-3H3;4,6H,1,5H2,2-3H3;6-7H,5H2,1-4H3;5-6H2,1-4H3;6-7H,5H2,1-4H3;2*7H,4-6H2,1-3H3;4,7H,1,5-6H2,2-3H3;5H,4H2,1-3H3;6H,4-5H2,1-3H3;5H,4H2,1-3H3;5-6H,1-4H3;2*6H,4-5H2,1-3H3;4,6H,1,5H2,2-3H3;1,6H,5H2,2-3H3;5H,4H2,1-3H3;5H,4H2,1-3H3;3H,1-2H3;4H,1-3H3.

What are the key properties of 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane?

2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane has a molecular weight of 2648.99 g/mol, XLogP of 66.86, 53 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclopropyl-1,1-dimethylcyclopropane;3,3-difluoro-2-methylpentane;2,3-dimethylbutane;4,4-dimethylheptane;2,5-dimethylhexane;3,3-dimethylhexane;2,2-dimethylpentane;2,3-dimethylpentane;2,4-dimethylpentane;2-ethenyl-1,1-dimethylcyclopropane;2-ethyl-1,1-dimethylcyclopropane;1-methoxy-3-methylbutane;1-methoxy-2-methylpropane;2-methylbutane;2-methylheptane;6-methylhept-1-ene;bis(2-methylhexane);5-methylhex-1-ene;bis(2-methylpentane);4-methylpent-1-ene;4-methylpent-1-yne;2-methylpropane;2-methylpropylcyclopropane;1,1,1-trifluoro-2-methylpropane;1,1,2-trimethylcyclopropane is sourced from PubChem (CID 158650941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).