2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane

C153H318 — CID 165099553

About 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane

2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane (PubChem CID 165099553) has the molecular formula C153H318 and a molecular weight of 2158.23 g/mol. Its IUPAC name is 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane.

Molecular Properties

• Compound Name: 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane
• PubChem CID: 165099553
• Molecular Formula: C153H318
• Molecular Weight: 2158.23 g/mol
• Exact Mass: 2156.49
• IUPAC Name: 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane
• SMILES: CC(C)C(C)C.CC(C)C1CC(C)(C)C1.CC(C)C1CC2(CCC2)C1.CC(C)C1CCC(C)(C)CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)CC(C)(C)C.CC(C)CC(C)C.CC(C)CC1CCC1.CC(C)CC1CCCC1.CC(C)CCC(C)C.CC(C)Cc1ccccc1.CCC(CC)CC(C)C.CCCC(C)C.CCCCC(C)C.CCCCCC(C)C.CCCCCCC(C)C.CCCCCCCCC(C)C
• InChI: InChI=1S/C11H22.C11H24.C10H18.C10H14.3C9H18.2C9H20.2C8H16.3C8H18.2C7H16.2C6H14/c1-9(2)10-5-7-11(3,4)8-6-10;1-4-5-6-7-8-9-10-11(2)3;1-8(2)9-6-10(7-9)4-3-5-10;1-9(2)8-10-6-4-3-5-7-10;1-7(2)8-5-9(3,4)6-8;1-8(2)7-9-5-3-4-6-9;1-8(2)9-6-4-3-5-7-9;1-5-9(6-2)7-8(3)4;1-4-5-6-7-8-9(2)3;1-7(2)6-8-4-3-5-8;1-7(2)8-5-3-4-6-8;1-7(2)6-8(3,4)5;1-7(2)5-6-8(3)4;1-4-5-6-7-8(2)3;1-6(2)5-7(3)4;1-4-5-6-7(2)3;1-5(2)6(3)4;1-4-5-6(2)3/h9-10H,5-8H2,1-4H3;11H,4-10H2,1-3H3;8-9H,3-7H2,1-2H3;3-7,9H,8H2,1-2H3;7-8H,5-6H2,1-4H3;2*8-9H,3-7H2,1-2H3;8-9H,5-7H2,1-4H3;9H,4-8H2,1-3H3;2*7-8H,3-6H2,1-2H3;7H,6H2,1-5H3;7-8H,5-6H2,1-4H3;8H,4-7H2,1-3H3;6-7H,5H2,1-4H3;7H,4-6H2,1-3H3;5-6H,1-4H3;6H,4-5H2,1-3H3
• InChIKey: YCCSFKLCQRCVKG-UHFFFAOYSA-N
• XLogP: 56.27
• TPSA: 0.00 Ų
• Rotatable Bonds: 43
• Heavy Atoms: 153
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2158.23
LogP ≤ 5	56.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane?

The IUPAC name of 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane (CID 165099553) is 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane.

What is the SMILES notation for 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane?

The canonical SMILES for 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane is CC(C)C(C)C.CC(C)C1CC(C)(C)C1.CC(C)C1CC2(CCC2)C1.CC(C)C1CCC(C)(C)CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)CC(C)(C)C.CC(C)CC(C)C.CC(C)CC1CCC1.CC(C)CC1CCCC1.CC(C)CCC(C)C.CC(C)Cc1ccccc1.CCC(CC)CC(C)C.CCCC(C)C.CCCCC(C)C.CCCCCC(C)C.CCCCCCC(C)C.CCCCCCCCC(C)C.

What is the InChIKey of 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane?

The InChIKey is YCCSFKLCQRCVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22.C11H24.C10H18.C10H14.3C9H18.2C9H20.2C8H16.3C8H18.2C7H16.2C6H14/c1-9(2)10-5-7-11(3,4)8-6-10;1-4-5-6-7-8-9-10-11(2)3;1-8(2)9-6-10(7-9)4-3-5-10;1-9(2)8-10-6-4-3-5-7-10;1-7(2)8-5-9(3,4)6-8;1-8(2)7-9-5-3-4-6-9;1-8(2)9-6-4-3-5-7-9;1-5-9(6-2)7-8(3)4;1-4-5-6-7-8-9(2)3;1-7(2)6-8-4-3-5-8;1-7(2)8-5-3-4-6-8;1-7(2)6-8(3,4)5;1-7(2)5-6-8(3)4;1-4-5-6-7-8(2)3;1-6(2)5-7(3)4;1-4-5-6-7(2)3;1-5(2)6(3)4;1-4-5-6(2)3/h9-10H,5-8H2,1-4H3;11H,4-10H2,1-3H3;8-9H,3-7H2,1-2H3;3-7,9H,8H2,1-2H3;7-8H,5-6H2,1-4H3;2*8-9H,3-7H2,1-2H3;8-9H,5-7H2,1-4H3;9H,4-8H2,1-3H3;2*7-8H,3-6H2,1-2H3;7H,6H2,1-5H3;7-8H,5-6H2,1-4H3;8H,4-7H2,1-3H3;6-7H,5H2,1-4H3;7H,4-6H2,1-3H3;5-6H,1-4H3;6H,4-5H2,1-3H3.

What are the key properties of 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane?

2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane has a molecular weight of 2158.23 g/mol, XLogP of 56.27, 43 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-dimethylbutane;2,5-dimethylhexane;2,4-dimethylpentane;1,1-dimethyl-3-propan-2-ylcyclobutane;1,1-dimethyl-4-propan-2-ylcyclohexane;4-ethyl-2-methylhexane;2-methyldecane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane;2-methylpropylbenzene;2-methylpropylcyclobutane;2-methylpropylcyclopentane;propan-2-ylcyclohexane;propan-2-ylcyclopentane;2-propan-2-ylspiro[3.3]heptane;2,2,4-trimethylpentane is sourced from PubChem (CID 165099553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).