1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane

C90H198 — CID 163814216

About 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane

1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane (PubChem CID 163814216) has the molecular formula C90H198 and a molecular weight of 1280.57 g/mol. Its IUPAC name is 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane.

Molecular Properties

• Compound Name: 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane
• PubChem CID: 163814216
• Molecular Formula: C90H198
• Molecular Weight: 1280.57 g/mol
• Exact Mass: 1279.55
• IUPAC Name: 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane
• SMILES: CC(C)(C)C(C)(C)C.CC(C)(C)C(C)(C)C.CC(C)(C)C(C)(C)C.CC(C)C(C)(C)C(C)C.CC(C)C(C)C(C)C.CC(C)[C@@H](C)C(C)(C)C.CC1(C2CC2)CC1.CCC(C)(C)C(C)(C)C.CCC(C)(C)C(C)C.CCC(C)C(C)(C)C.CC[C@@H](C)C(C)(C)C
• InChI: InChI=1S/3C9H20.7C8H18.C7H12/c1-7-9(5,6)8(2,3)4;1-7(2)8(3)9(4,5)6;1-7(2)9(5,6)8(3)4;3*1-7(2,3)8(4,5)6;2*1-6-7(2)8(3,4)5;1-6-8(4,5)7(2)3;1-6(2)8(5)7(3)4;1-7(4-5-7)6-2-3-6/h7H2,1-6H3;2*7-8H,1-6H3;3*1-6H3;3*7H,6H2,1-5H3;6-8H,1-5H3;6H,2-5H2,1H3/t;8-;;;;;7-;;;;/m.1....1..../s1
• InChIKey: NPXJNLWCEQYBRB-WIUYUDOGSA-N
• XLogP: 33.72
• TPSA: 0.00 Ų
• Rotatable Bonds: 11
• Heavy Atoms: 90
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1280.57
LogP ≤ 5	33.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane?

The IUPAC name of 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane (CID 163814216) is 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane.

What is the SMILES notation for 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane?

The canonical SMILES for 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane is CC(C)(C)C(C)(C)C.CC(C)(C)C(C)(C)C.CC(C)(C)C(C)(C)C.CC(C)C(C)(C)C(C)C.CC(C)C(C)C(C)C.CC(C)[C@@H](C)C(C)(C)C.CC1(C2CC2)CC1.CCC(C)(C)C(C)(C)C.CCC(C)(C)C(C)C.CCC(C)C(C)(C)C.CC[C@@H](C)C(C)(C)C.

What is the InChIKey of 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane?

The InChIKey is NPXJNLWCEQYBRB-WIUYUDOGSA-N. The full InChI is InChI=1S/3C9H20.7C8H18.C7H12/c1-7-9(5,6)8(2,3)4;1-7(2)8(3)9(4,5)6;1-7(2)9(5,6)8(3)4;3*1-7(2,3)8(4,5)6;2*1-6-7(2)8(3,4)5;1-6-8(4,5)7(2)3;1-6(2)8(5)7(3)4;1-7(4-5-7)6-2-3-6/h7H2,1-6H3;2*7-8H,1-6H3;3*1-6H3;3*7H,6H2,1-5H3;6-8H,1-5H3;6H,2-5H2,1H3/t;8-;;;;;7-;;;;/m.1....1..../s1.

What are the key properties of 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane?

1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane has a molecular weight of 1280.57 g/mol, XLogP of 33.72, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-1-methylcyclopropane;tris(2,2,3,3-tetramethylbutane);2,2,3,3-tetramethylpentane;2,3,3,4-tetramethylpentane;(3R)-2,2,3,4-tetramethylpentane;2,2,3-trimethylpentane;2,3,3-trimethylpentane;2,3,4-trimethylpentane;(3R)-2,2,3-trimethylpentane is sourced from PubChem (CID 163814216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).