4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane

C155H254 — CID 159964696

About 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane

4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane (PubChem CID 159964696) has the molecular formula C155H254 and a molecular weight of 2117.74 g/mol. Its IUPAC name is 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane.

Molecular Properties

• Compound Name: 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane
• PubChem CID: 159964696
• Molecular Formula: C155H254
• Molecular Weight: 2117.74 g/mol
• Exact Mass: 2115.99
• IUPAC Name: 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane
• SMILES: CC1C(C)C2C3CC(C12)C1C(C)C(C)C31.CC1C(C)C2C3CC(C12)C1C2CC(C4C(C)C(C)C24)C31.CC1C(C)C2CC1C1C(C)C(C)C21.CC1C(C)C2CC1C1C3CC(C(C)C3C)C21.CC1CC(C)C2C(C)CC(C)C12.CC1CCC(C2CCC(C)C(C)C2)CC1C.CCC(C)C1(C)CC(C)C(C)c2ccccc21.CCC(C)C1C=C(C)C(C)C(C)C1.CCC(C)C1CC(C)C(C)c2cc(C)ccc21.CCC(C)C1CC(C)C(C)c2ccccc21
• InChI: InChI=1S/C20H30.2C17H26.C16H26.C16H30.C16H24.C15H24.C13H22.C13H24.C12H22/c1-7-8(2)16-12-5-11(15(7)16)19-13-6-14(20(12)19)18-10(4)9(3)17(13)18;1-6-12(3)16-10-13(4)14(5)17-9-11(2)7-8-15(16)17;1-6-13(3)17(5)11-12(2)14(4)15-9-7-8-10-16(15)17;1-7-8(2)12-5-11(7)15-13-6-14(16(12)15)10(4)9(13)3;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-5-11(2)16-10-12(3)13(4)14-8-6-7-9-15(14)16;1-6-7(2)13-11-5-10(12(6)13)14-8(3)9(4)15(11)14;1-6-7(2)11-5-10(6)12-8(3)9(4)13(11)12;1-6-9(2)13-7-10(3)12(5)11(4)8-13;1-7-5-8(2)12-10(4)6-9(3)11(7)12/h7-20H,5-6H2,1-4H3;7-9,12-14,16H,6,10H2,1-5H3;7-10,12-14H,6,11H2,1-5H3;7-16H,5-6H2,1-4H3;11-16H,5-10H2,1-4H3;6-9,11-13,16H,5,10H2,1-4H3;6-15H,5H2,1-4H3;6-13H,5H2,1-4H3;7,9,11-13H,6,8H2,1-5H3;7-12H,5-6H2,1-4H3
• InChIKey: ODTZEHDZXCKFMB-UHFFFAOYSA-N
• XLogP: 44.05
• TPSA: 0.00 Ų
• Rotatable Bonds: 9
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2117.74
LogP ≤ 5	44.05
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane?

The IUPAC name of 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane (CID 159964696) is 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane.

What is the SMILES notation for 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane?

The canonical SMILES for 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane is CC1C(C)C2C3CC(C12)C1C(C)C(C)C31.CC1C(C)C2C3CC(C12)C1C2CC(C4C(C)C(C)C24)C31.CC1C(C)C2CC1C1C(C)C(C)C21.CC1C(C)C2CC1C1C3CC(C(C)C3C)C21.CC1CC(C)C2C(C)CC(C)C12.CC1CCC(C2CCC(C)C(C)C2)CC1C.CCC(C)C1(C)CC(C)C(C)c2ccccc21.CCC(C)C1C=C(C)C(C)C(C)C1.CCC(C)C1CC(C)C(C)c2cc(C)ccc21.CCC(C)C1CC(C)C(C)c2ccccc21.

What is the InChIKey of 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane?

The InChIKey is ODTZEHDZXCKFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30.2C17H26.C16H26.C16H30.C16H24.C15H24.C13H22.C13H24.C12H22/c1-7-8(2)16-12-5-11(15(7)16)19-13-6-14(20(12)19)18-10(4)9(3)17(13)18;1-6-12(3)16-10-13(4)14(5)17-9-11(2)7-8-15(16)17;1-6-13(3)17(5)11-12(2)14(4)15-9-7-8-10-16(15)17;1-7-8(2)12-5-11(7)15-13-6-14(16(12)15)10(4)9(13)3;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-5-11(2)16-10-12(3)13(4)14-8-6-7-9-15(14)16;1-6-7(2)13-11-5-10(12(6)13)14-8(3)9(4)15(11)14;1-6-7(2)11-5-10(6)12-8(3)9(4)13(11)12;1-6-9(2)13-7-10(3)12(5)11(4)8-13;1-7-5-8(2)12-10(4)6-9(3)11(7)12/h7-20H,5-6H2,1-4H3;7-9,12-14,16H,6,10H2,1-5H3;7-10,12-14H,6,11H2,1-5H3;7-16H,5-6H2,1-4H3;11-16H,5-10H2,1-4H3;6-9,11-13,16H,5,10H2,1-4H3;6-15H,5H2,1-4H3;6-13H,5H2,1-4H3;7,9,11-13H,6,8H2,1-5H3;7-12H,5-6H2,1-4H3.

What are the key properties of 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane?

4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane has a molecular weight of 2117.74 g/mol, XLogP of 44.05, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 4-butan-2-yl-1,2-dimethyl-1,2,3,4-tetrahydronaphthalene;3-butan-2-yl-1,5,6-trimethylcyclohexene;4-butan-2-yl-1,2,4-trimethyl-2,3-dihydro-1H-naphthalene;4-butan-2-yl-1,2,7-trimethyl-1,2,3,4-tetrahydronaphthalene;4-(3,4-dimethylcyclohexyl)-1,2-dimethylcyclohexane;1,3,4,6-tetramethyl-1,2,3,3a,4,5,6,6a-octahydropentalene;5,6,12,13-tetramethylhexacyclo[8.4.1.13,8.02,9.04,7.011,14]hexadecane;4,5,9,10-tetramethyltetracyclo[6.2.1.13,6.02,7]dodecane;3,4,8,9-tetramethyltetracyclo[4.4.1.02,5.07,10]undecane;3,4,7,8-tetramethyltricyclo[4.2.1.02,5]nonane is sourced from PubChem (CID 159964696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).