8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane

C16H28O — CID 174350007

IUPAC8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane
SMILESCOCC(C)(C)C1(C)CC2CC1C1CCCC21
InChIInChI=1S/C16H28O/c1-15(2,10-17-4)16(3)9-11-8-14(16)13-7-5-6-12(11)13/h11-14H,5-10H2,1-4H3
InChIKeyMUNKHSNZPIHLFF-UHFFFAOYSA-N
MW236.40 g/mol
LogP4.12
Rot. Bonds3

About 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane

8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane (PubChem CID 174350007) has the molecular formula C16H28O and a molecular weight of 236.40 g/mol. Its IUPAC name is 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane.

Molecular Properties

Compound Name8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane
PubChem CID174350007
Molecular FormulaC16H28O
Molecular Weight236.40 g/mol
Exact Mass236.21
IUPAC Name8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane
SMILESCOCC(C)(C)C1(C)CC2CC1C1CCCC21
InChIInChI=1S/C16H28O/c1-15(2,10-17-4)16(3)9-11-8-14(16)13-7-5-6-12(11)13/h11-14H,5-10H2,1-4H3
InChIKeyMUNKHSNZPIHLFF-UHFFFAOYSA-N
XLogP4.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane?
The IUPAC name of 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane (CID 174350007) is 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane.
What is the SMILES notation for 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane?
The canonical SMILES for 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane is COCC(C)(C)C1(C)CC2CC1C1CCCC21.
What is the InChIKey of 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane?
The InChIKey is MUNKHSNZPIHLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O/c1-15(2,10-17-4)16(3)9-11-8-14(16)13-7-5-6-12(11)13/h11-14H,5-10H2,1-4H3.
What are the key properties of 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane?
8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane has a molecular weight of 236.40 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-methoxy-2-methylpropan-2-yl)-8-methyltricyclo[5.2.1.02,6]decane is sourced from PubChem (CID 174350007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).