2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol

C10H16O — CID 13096479

IUPAC2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol
SMILESC=C1C2CCC(O)(C2)C1(C)C
InChIInChI=1S/C10H16O/c1-7-8-4-5-10(11,6-8)9(7,2)3/h8,11H,1,4-6H2,2-3H3
InChIKeyRBAYRAWUGYZBAT-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.11
Rot. Bonds

About 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol

2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol (PubChem CID 13096479) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol
PubChem CID13096479
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol
SMILESC=C1C2CCC(O)(C2)C1(C)C
InChIInChI=1S/C10H16O/c1-7-8-4-5-10(11,6-8)9(7,2)3/h8,11H,1,4-6H2,2-3H3
InChIKeyRBAYRAWUGYZBAT-UHFFFAOYSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Camphenol, 6-
CID 526611
2,3-Dimethyl-3-(4-methyl-3-pentenyl)-2-norbornanol
CID 6429259
6,6-Dimethyl-5-methylidenebicyclo[2.2.1]heptan-2-ol
CID 85185505
Exo-2-methyl-3-methylenebicyclo[2.2.1]heptan-2-ol
CID 67760064
3,3-Dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-OL
CID 339872
(1R,2S,3R,4S)-2,3-dimethyl-3-(4-methylpent-3-enyl)bicyclo[2.2.1]heptan-2-ol
CID 10082297
6-Camphenol
CID 180537
Bicyclo[2.2.1]heptan-1-ol, 3,3-dimethyl-2-methylene-, (1R,4R)-
CID 11094821
(1R,2S,4S)-2-Methyl-3-methylidenebicyclo[2.2.1]heptan-2-ol
CID 162890626
Spirojatamol
CID 11053257
Bicyclo[2.2.1]heptan-2-ol, 2-allyl-1,7,7-trimethyl-
CID 4918971
2-[(1S)-1-methyl-8-methylidenespiro[4.5]decan-4-yl]propan-2-ol
CID 6430766

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol?
The IUPAC name of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol (CID 13096479) is 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol is C=C1C2CCC(O)(C2)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol?
The InChIKey is RBAYRAWUGYZBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-7-8-4-5-10(11,6-8)9(7,2)3/h8,11H,1,4-6H2,2-3H3.
What are the key properties of 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol?
2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-ol is sourced from PubChem (CID 13096479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).