2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane

C105H192 — CID 161435215

About 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane

2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane (PubChem CID 161435215) has the molecular formula C105H192 and a molecular weight of 1454.69 g/mol. Its IUPAC name is 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane.

Molecular Properties

• Compound Name: 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane
• PubChem CID: 161435215
• Molecular Formula: C105H192
• Molecular Weight: 1454.69 g/mol
• Exact Mass: 1453.50
• IUPAC Name: 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane
• SMILES: CC1C2CCC(C2)C1C.CC1CC2CC(C)C1C2.CC1CC2CC1CC2C.CC1CCCC(CC2CCCC(C)C2)C1.CC1CCCC(CC2CCCCC2C)C1.CC1CCCCC1CC1CCCCC1C.CCC1C2CCC(C2)C1CC.CCC1CC2CC(CC)C1C2.CCC1CC2CC1CC2CC
• InChI: InChI=1S/3C15H28.3C11H20.3C9H16/c1-12-5-3-7-14(9-12)11-15-8-4-6-13(2)10-15;1-12-7-3-5-9-14(12)11-15-10-6-4-8-13(15)2;1-12-6-5-8-14(10-12)11-15-9-4-3-7-13(15)2;1-3-9-5-8-6-10(4-2)11(9)7-8;1-3-8-5-11-7-10(8)6-9(11)4-2;1-3-10-8-5-6-9(7-8)11(10)4-2;1-6-3-9-5-8(6)4-7(9)2;1-6-3-8-4-7(2)9(6)5-8;1-6-7(2)9-4-3-8(6)5-9/h3*12-15H,3-11H2,1-2H3;3*8-11H,3-7H2,1-2H3;3*6-9H,3-5H2,1-2H3
• InChIKey: VYOBMWHGNWKKLF-UHFFFAOYSA-N
• XLogP: 33.56
• TPSA: 0.00 Ų
• Rotatable Bonds: 12
• Heavy Atoms: 105
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1454.69
LogP ≤ 5	33.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane?

The IUPAC name of 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane (CID 161435215) is 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane.

What is the SMILES notation for 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane?

The canonical SMILES for 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane is CC1C2CCC(C2)C1C.CC1CC2CC(C)C1C2.CC1CC2CC1CC2C.CC1CCCC(CC2CCCC(C)C2)C1.CC1CCCC(CC2CCCCC2C)C1.CC1CCCCC1CC1CCCCC1C.CCC1C2CCC(C2)C1CC.CCC1CC2CC(CC)C1C2.CCC1CC2CC1CC2CC.

What is the InChIKey of 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane?

The InChIKey is VYOBMWHGNWKKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C15H28.3C11H20.3C9H16/c1-12-5-3-7-14(9-12)11-15-8-4-6-13(2)10-15;1-12-7-3-5-9-14(12)11-15-10-6-4-8-13(15)2;1-12-6-5-8-14(10-12)11-15-9-4-3-7-13(15)2;1-3-9-5-8-6-10(4-2)11(9)7-8;1-3-8-5-11-7-10(8)6-9(11)4-2;1-3-10-8-5-6-9(7-8)11(10)4-2;1-6-3-9-5-8(6)4-7(9)2;1-6-3-8-4-7(2)9(6)5-8;1-6-7(2)9-4-3-8(6)5-9/h3*12-15H,3-11H2,1-2H3;3*8-11H,3-7H2,1-2H3;3*6-9H,3-5H2,1-2H3.

What are the key properties of 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane?

2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane has a molecular weight of 1454.69 g/mol, XLogP of 33.56, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-diethylbicyclo[2.2.1]heptane;2,5-diethylbicyclo[2.2.1]heptane;2,6-diethylbicyclo[2.2.1]heptane;2,3-dimethylbicyclo[2.2.1]heptane;2,5-dimethylbicyclo[2.2.1]heptane;2,6-dimethylbicyclo[2.2.1]heptane;1-methyl-2-[(2-methylcyclohexyl)methyl]cyclohexane;1-methyl-2-[(3-methylcyclohexyl)methyl]cyclohexane;1-methyl-3-[(3-methylcyclohexyl)methyl]cyclohexane is sourced from PubChem (CID 161435215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).