6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]

C15H24 — CID 20680012

IUPAC6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]
SMILESCC1(C)CC2CC1C1(CC3CCC1C3)C2
InChIInChI=1S/C15H24/c1-14(2)7-11-6-13(14)15(9-11)8-10-3-4-12(15)5-10/h10-13H,3-9H2,1-2H3
InChIKeyVTEZBOJKTURVRF-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.25
Rot. Bonds

About 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]

6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] (PubChem CID 20680012) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane].

Molecular Properties

Compound Name6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]
PubChem CID20680012
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]
SMILESCC1(C)CC2CC1C1(CC3CCC1C3)C2
InChIInChI=1S/C15H24/c1-14(2)7-11-6-13(14)15(9-11)8-10-3-4-12(15)5-10/h10-13H,3-9H2,1-2H3
InChIKeyVTEZBOJKTURVRF-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S,4R)-2-methylbicyclo[2.2.1]heptan-2-ol
CID 134981260
(1S,2S,4R)-2-methylbicyclo[2.2.1]heptan-2-amine
CID 131148084
6,6-dimethylbicyclo[3.2.1]octane
CID 154531364
4'-methylspiro[bicyclo[2.2.1]heptane-2,3'-pyrrolidine]
CID 20705204
(1R,2S,4S)-2-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride
CID 178190368
N-[(2-cyclopentyl-2-bicyclo[2.2.1]heptanyl)methyl]propan-2-amine
CID 82933969
N-[(2-cycloheptyl-2-bicyclo[2.2.1]heptanyl)methyl]cyclopropanamine
CID 82934165
3-(2-methyl-2-bicyclo[2.2.1]heptanyl)propan-1-ol
CID 168807164
2,2-dimethylbicyclo[2.2.1]heptane;2-methyl-2-pentylbicyclo[2.2.1]heptane
CID 91122013
2-methyl-2-propylbicyclo[2.2.1]heptane
CID 20587119
1-[(1S,2S,4R)-2-methyl-2-bicyclo[2.2.1]heptanyl]ethanone
CID 131122993
2-propan-2-ylbicyclo[2.2.1]heptan-2-ol
CID 12648920

Frequently Asked Questions

What is the IUPAC name of 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]?
The IUPAC name of 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] (CID 20680012) is 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane].
What is the SMILES notation for 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]?
The canonical SMILES for 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] is CC1(C)CC2CC1C1(CC3CCC1C3)C2.
What is the InChIKey of 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]?
The InChIKey is VTEZBOJKTURVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-14(2)7-11-6-13(14)15(9-11)8-10-3-4-12(15)5-10/h10-13H,3-9H2,1-2H3.
What are the key properties of 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane]?
6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] has a molecular weight of 204.36 g/mol, XLogP of 4.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6',6'-dimethyl-2,2'-spirobi[bicyclo[2.2.1]heptane] is sourced from PubChem (CID 20680012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).