2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol

C15H26O — CID 534931

IUPAC2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol
SMILESCC1(C)CCCC2(O)C(C)(C)C3CCC12C3
InChIInChI=1S/C15H26O/c1-12(2)7-5-8-15(16)13(3,4)11-6-9-14(12,15)10-11/h11,16H,5-10H2,1-4H3
InChIKeyCCMWYZQSEJEAEY-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.75
Rot. Bonds

About 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol

2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol (PubChem CID 534931) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol.

Molecular Properties

Compound Name2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol
PubChem CID534931
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol
SMILESCC1(C)CCCC2(O)C(C)(C)C3CCC12C3
InChIInChI=1S/C15H26O/c1-12(2)7-5-8-15(16)13(3,4)11-6-9-14(12,15)10-11/h11,16H,5-10H2,1-4H3
InChIKeyCCMWYZQSEJEAEY-UHFFFAOYSA-N
XLogP3.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol?
The IUPAC name of 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol (CID 534931) is 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol.
What is the SMILES notation for 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol?
The canonical SMILES for 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol is CC1(C)CCCC2(O)C(C)(C)C3CCC12C3.
What is the InChIKey of 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol?
The InChIKey is CCMWYZQSEJEAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-12(2)7-5-8-15(16)13(3,4)11-6-9-14(12,15)10-11/h11,16H,5-10H2,1-4H3.
What are the key properties of 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol?
2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol has a molecular weight of 222.37 g/mol, XLogP of 3.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,8,8-tetramethyl-octahydro-1H-2,4a-methanonapthalen-9-ol is sourced from PubChem (CID 534931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).