butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane

C96H192 — CID 160862654

About butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane

butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane (PubChem CID 160862654) has the molecular formula C96H192 and a molecular weight of 1346.59 g/mol. Its IUPAC name is butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane.

Molecular Properties

• Compound Name: butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane
• PubChem CID: 160862654
• Molecular Formula: C96H192
• Molecular Weight: 1346.59 g/mol
• Exact Mass: 1345.50
• IUPAC Name: butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane
• SMILES: CC(C)(C)C1CCC1.CC1C(C)C(C)C1C.CC1CC(C(C)C)C1.CC1CC(C)C(C)C1.CC1CC(C)[C@@H](C)C1.CC1CCC(C)(C)C1.CC1CCC(C)C1C.CC1CCC(C)C1C.CC1CCCC1(C)C.CCC(C)C1CCC1.CCC1CCCC1C.C[C@H]1CCC(C)(C)C1
• InChI: InChI=1S/12C8H16/c2*1-6-4-7(2)8(3)5-6;1-6(2)8-4-7(3)5-8;2*1-7-4-5-8(2,3)6-7;1-8(2,3)7-5-4-6-7;1-7-5-4-6-8(7,2)3;2*1-6-4-5-7(2)8(6)3;1-5-6(2)8(4)7(5)3;1-3-8-6-4-5-7(8)2;1-3-7(2)8-5-4-6-8/h3*6-8H,4-5H2,1-3H3;4*7H,4-6H2,1-3H3;2*6-8H,4-5H2,1-3H3;5-8H,1-4H3;2*7-8H,3-6H2,1-2H3/t6?,7-,8?;;;7-;;;;;;;;/m0..0......../s1
• InChIKey: SKRPFSPDEZRPCX-FVQCGFQMSA-N
• XLogP: 32.98
• TPSA: 0.00 Ų
• Rotatable Bonds: 4
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1346.59
LogP ≤ 5	32.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane?

The IUPAC name of butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane (CID 160862654) is butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane.

What is the SMILES notation for butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane?

The canonical SMILES for butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane is CC(C)(C)C1CCC1.CC1C(C)C(C)C1C.CC1CC(C(C)C)C1.CC1CC(C)C(C)C1.CC1CC(C)[C@@H](C)C1.CC1CCC(C)(C)C1.CC1CCC(C)C1C.CC1CCC(C)C1C.CC1CCCC1(C)C.CCC(C)C1CCC1.CCC1CCCC1C.C[C@H]1CCC(C)(C)C1.

What is the InChIKey of butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane?

The InChIKey is SKRPFSPDEZRPCX-FVQCGFQMSA-N. The full InChI is InChI=1S/12C8H16/c2*1-6-4-7(2)8(3)5-6;1-6(2)8-4-7(3)5-8;2*1-7-4-5-8(2,3)6-7;1-8(2,3)7-5-4-6-7;1-7-5-4-6-8(7,2)3;2*1-6-4-5-7(2)8(6)3;1-5-6(2)8(4)7(5)3;1-3-8-6-4-5-7(8)2;1-3-7(2)8-5-4-6-8/h3*6-8H,4-5H2,1-3H3;4*7H,4-6H2,1-3H3;2*6-8H,4-5H2,1-3H3;5-8H,1-4H3;2*7-8H,3-6H2,1-2H3/t6?,7-,8?;;;7-;;;;;;;;/m0..0......../s1.

What are the key properties of butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane?

butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane has a molecular weight of 1346.59 g/mol, XLogP of 32.98, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for butan-2-ylcyclobutane;tert-butylcyclobutane;1-ethyl-2-methylcyclopentane;1-methyl-3-propan-2-ylcyclobutane;1,2,3,4-tetramethylcyclobutane;1,1,2-trimethylcyclopentane;1,1,3-trimethylcyclopentane;bis(1,2,3-trimethylcyclopentane);1,2,4-trimethylcyclopentane;(2S)-1,2,4-trimethylcyclopentane;(3S)-1,1,3-trimethylcyclopentane is sourced from PubChem (CID 160862654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).