2,2-diethyladamantan-1-ol

C14H24O — CID 22670607

IUPAC2,2-diethyladamantan-1-ol
SMILESCCC1(CC)C2CC3CC(C2)CC1(O)C3
InChIInChI=1S/C14H24O/c1-3-13(4-2)12-6-10-5-11(7-12)9-14(13,15)8-10/h10-12,15H,3-9H2,1-2H3
InChIKeyZHKJUMKBHQYYQW-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.36
Rot. Bonds2

About 2,2-diethyladamantan-1-ol

2,2-diethyladamantan-1-ol (PubChem CID 22670607) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 2,2-diethyladamantan-1-ol.

Molecular Properties

Compound Name2,2-diethyladamantan-1-ol
PubChem CID22670607
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name2,2-diethyladamantan-1-ol
SMILESCCC1(CC)C2CC3CC(C2)CC1(O)C3
InChIInChI=1S/C14H24O/c1-3-13(4-2)12-6-10-5-11(7-12)9-14(13,15)8-10/h10-12,15H,3-9H2,1-2H3
InChIKeyZHKJUMKBHQYYQW-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyladamantan-1-ol?
The IUPAC name of 2,2-diethyladamantan-1-ol (CID 22670607) is 2,2-diethyladamantan-1-ol.
What is the SMILES notation for 2,2-diethyladamantan-1-ol?
The canonical SMILES for 2,2-diethyladamantan-1-ol is CCC1(CC)C2CC3CC(C2)CC1(O)C3.
What is the InChIKey of 2,2-diethyladamantan-1-ol?
The InChIKey is ZHKJUMKBHQYYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-3-13(4-2)12-6-10-5-11(7-12)9-14(13,15)8-10/h10-12,15H,3-9H2,1-2H3.
What are the key properties of 2,2-diethyladamantan-1-ol?
2,2-diethyladamantan-1-ol has a molecular weight of 208.34 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyladamantan-1-ol is sourced from PubChem (CID 22670607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).