2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane

C14H22O — CID 22404545

IUPAC2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane
SMILESC1CC2CC1CC2OC1CC2CCC1C2
InChIInChI=1S/C14H22O/c1-3-11-5-9(1)7-13(11)15-14-8-10-2-4-12(14)6-10/h9-14H,1-8H2
InChIKeyHYLNTCREQZFMBY-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.38
Rot. Bonds2

About 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane

2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane (PubChem CID 22404545) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane
PubChem CID22404545
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane
SMILESC1CC2CC1CC2OC1CC2CCC1C2
InChIInChI=1S/C14H22O/c1-3-11-5-9(1)7-13(11)15-14-8-10-2-4-12(14)6-10/h9-14H,1-8H2
InChIKeyHYLNTCREQZFMBY-UHFFFAOYSA-N
XLogP3.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]oxy]-N-methylmethanamine
CID 99908285
N-(2-bicyclo[2.2.1]heptanyloxy)-N-methylmethanamine
CID 76852044
[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl] formate
CID 98108160
CID 154594551
CID 154594551
2-(2-bicyclo[2.2.1]heptanyloxy)-1,3-benzodioxole
CID 19378874
2-[amino(2-bicyclo[2.2.1]heptanyloxy)phosphinothioyl]oxybicyclo[2.2.1]heptane
CID 91238700
2-bicyclo[2.2.1]heptanyloxymethanedithioic acid
CID 511673
2-bicyclo[2.2.1]heptanyl nitrate
CID 12594107
(1S,2S,4R)-2-prop-2-enoxybicyclo[2.2.1]heptane
CID 102261355
2-(2-methoxyethoxy)bicyclo[2.2.1]heptane
CID 12652893
bis(2-bicyclo[2.2.1]heptanyl) ethane-1,2-disulfonate
CID 89483111
2-but-3-en-2-yloxybicyclo[2.2.1]heptane
CID 70152975

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane (CID 22404545) is 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane is C1CC2CC1CC2OC1CC2CCC1C2.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane?
The InChIKey is HYLNTCREQZFMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-3-11-5-9(1)7-13(11)15-14-8-10-2-4-12(14)6-10/h9-14H,1-8H2.
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane?
2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane has a molecular weight of 206.33 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanyloxy)bicyclo[2.2.1]heptane is sourced from PubChem (CID 22404545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).