(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol

C11H20O — CID 89090386

IUPAC(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol
SMILESCCC1CC2CC1C(C)(CO)C2
InChIInChI=1S/C11H20O/c1-3-9-4-8-5-10(9)11(2,6-8)7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyORNFQBLCLOVHQX-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.44
Rot. Bonds2

About (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol

(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol (PubChem CID 89090386) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol.

Molecular Properties

Compound Name(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol
PubChem CID89090386
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol
SMILESCCC1CC2CC1C(C)(CO)C2
InChIInChI=1S/C11H20O/c1-3-9-4-8-5-10(9)11(2,6-8)7-12/h8-10,12H,3-7H2,1-2H3
InChIKeyORNFQBLCLOVHQX-UHFFFAOYSA-N
XLogP2.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol?
The IUPAC name of (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol (CID 89090386) is (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol.
What is the SMILES notation for (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol?
The canonical SMILES for (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol is CCC1CC2CC1C(C)(CO)C2.
What is the InChIKey of (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol?
The InChIKey is ORNFQBLCLOVHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O/c1-3-9-4-8-5-10(9)11(2,6-8)7-12/h8-10,12H,3-7H2,1-2H3.
What are the key properties of (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol?
(6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol has a molecular weight of 168.28 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethyl-2-methyl-2-bicyclo[2.2.1]heptanyl)methanol is sourced from PubChem (CID 89090386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).