(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol

C15H26O — CID 162918833

IUPAC(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol
SMILESC/C1=C\CC(C)(C)C[C@@H](O)C/C(C)=C/CC1
InChIInChI=1S/C15H26O/c1-12-6-5-7-13(2)10-14(16)11-15(3,4)9-8-12/h7-8,14,16H,5-6,9-11H2,1-4H3/b12-8+,13-7+/t14-/m0/s1
InChIKeyAKGDUZYRIHUKMK-OZYJHPDRSA-N
MW222.37 g/mol
LogP4.23
Rot. Bonds

About (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol

(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol (PubChem CID 162918833) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol.

Molecular Properties

Compound Name(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol
PubChem CID162918833
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol
SMILESC/C1=C\CC(C)(C)C[C@@H](O)C/C(C)=C/CC1
InChIInChI=1S/C15H26O/c1-12-6-5-7-13(2)10-14(16)11-15(3,4)9-8-12/h7-8,14,16H,5-6,9-11H2,1-4H3/b12-8+,13-7+/t14-/m0/s1
InChIKeyAKGDUZYRIHUKMK-OZYJHPDRSA-N
XLogP4.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol 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

Cryptoxanthin
CID 5281235
Dehydrodihydroionol
CID 62126
Camelliol C
CID 6476390
Rubixanthin
CID 5281252
Sandalore
CID 103212
1-Terpinen-5-ol
CID 68124095
3,7-Cycloundecadien-1-ol, 1,5,5,8-tetramethyl-, (-)-
CID 14093951
4,8-Dimethyl-7-nonen-2-ol
CID 162418
5,9-Dimethyl-8-decen-3-ol
CID 89186
2-Cyclohexene-1-propanol, alpha,2,6,6-tetramethyl-
CID 166894
Cryptoxanthin, (+/-)-
CID 6384256
Partheniol
CID 76315918

Frequently Asked Questions

What is the IUPAC name of (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol?
The IUPAC name of (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol (CID 162918833) is (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol.
What is the SMILES notation for (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol?
The canonical SMILES for (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol is C/C1=C\CC(C)(C)C[C@@H](O)C/C(C)=C/CC1.
What is the InChIKey of (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol?
The InChIKey is AKGDUZYRIHUKMK-OZYJHPDRSA-N. The full InChI is InChI=1S/C15H26O/c1-12-6-5-7-13(2)10-14(16)11-15(3,4)9-8-12/h7-8,14,16H,5-6,9-11H2,1-4H3/b12-8+,13-7+/t14-/m0/s1.
What are the key properties of (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol?
(1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol has a molecular weight of 222.37 g/mol, XLogP of 4.23, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3E,7E)-3,7,10,10-tetramethylcycloundeca-3,7-dien-1-ol is sourced from PubChem (CID 162918833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).