2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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

C103H230 — CID 163815979

About 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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

2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 163815979) has the molecular formula C103H230 and a molecular weight of 1468.97 g/mol. Its IUPAC name is 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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: 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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: 163815979
• Molecular Formula: C103H230
• Molecular Weight: 1468.97 g/mol
• Exact Mass: 1467.80
• IUPAC Name: 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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)(C)C.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)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.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/2C10H22.3C9H20.7C8H18/c1-8(9(2,3)4)10(5,6)7;1-8(2)10(6,7)9(3,4)5;1-7-9(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/h2*8H,1-7H3;7H2,1-6H3;2*7-8H,1-6H3;3*1-6H3;3*7H,6H2,1-5H3;6-8H,1-5H3/t;;;8-;;;;;7-;;;/m...1....1.../s1
• InChIKey: NRJHRYSFGKPRNP-GTQXQGQSSA-N
• XLogP: 38.95
• TPSA: 0.00 Ų
• Rotatable Bonds: 11
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1468.97
LogP ≤ 5	38.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 163815979) is 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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)(C)C.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)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.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 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 NRJHRYSFGKPRNP-GTQXQGQSSA-N. The full InChI is InChI=1S/2C10H22.3C9H20.7C8H18/c1-8(9(2,3)4)10(5,6)7;1-8(2)10(6,7)9(3,4)5;1-7-9(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/h2*8H,1-7H3;7H2,1-6H3;2*7-8H,1-6H3;3*1-6H3;3*7H,6H2,1-5H3;6-8H,1-5H3/t;;;8-;;;;;7-;;;/m...1....1.../s1.

What are the key properties of 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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?

2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 1468.97 g/mol, XLogP of 38.95, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2,3,3,4-pentamethylpentane;2,2,3,4,4-pentamethylpentane;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 163815979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).