(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol

C15H24O — CID 91750370

IUPAC(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol
SMILESC/C1=C/C[C@@H]2/C(=C(/C)CC[C@H]1O)CC2(C)C
InChIInChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h5,13-14,16H,6-9H2,1-4H3/b11-5-,12-10-/t13-,14-/m1/s1
InChIKeyAHWWWENJXIHBBP-MOWKOEKMSA-N
MW220.36 g/mol
LogP3.84
Rot. Bonds

About (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol

(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol (PubChem CID 91750370) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol.

Molecular Properties

Compound Name(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol
PubChem CID91750370
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol
SMILESC/C1=C/C[C@@H]2/C(=C(/C)CC[C@H]1O)CC2(C)C
InChIInChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h5,13-14,16H,6-9H2,1-4H3/b11-5-,12-10-/t13-,14-/m1/s1
InChIKeyAHWWWENJXIHBBP-MOWKOEKMSA-N
XLogP3.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol with MolForge

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Related Compounds

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CID 163105865
2,2,6-trimethyl-3,3a,4,6a-tetrahydro-1H-pentalen-1-ol
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CID 134839989
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3,3-dimethylcyclopentane-1,2-diol
CID 22245615
(4S,5E,8R,9R)-4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
CID 24939423
4-hydroxy-5-methyl-8-prop-1-en-2-yl-10-oxabicyclo[7.2.1]dodeca-1(12),5-dien-11-one
CID 74369134
[(2S)-2-[(1S,3Z,7E,11R,12E,15S)-11,17-dihydroxy-1,4,8,12-tetramethyl-18-oxo-16-bicyclo[13.3.0]octadeca-3,7,12,16-tetraenyl]propyl] acetate
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CID 173230826

Frequently Asked Questions

What is the IUPAC name of (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol?
The IUPAC name of (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol (CID 91750370) is (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol.
What is the SMILES notation for (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol?
The canonical SMILES for (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol is C/C1=C/C[C@@H]2/C(=C(/C)CC[C@H]1O)CC2(C)C.
What is the InChIKey of (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol?
The InChIKey is AHWWWENJXIHBBP-MOWKOEKMSA-N. The full InChI is InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h5,13-14,16H,6-9H2,1-4H3/b11-5-,12-10-/t13-,14-/m1/s1.
What are the key properties of (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol?
(1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol has a molecular weight of 220.36 g/mol, XLogP of 3.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5R,6Z,9S)-2,6,10,10-tetramethylbicyclo[7.2.0]undeca-1,6-dien-5-ol is sourced from PubChem (CID 91750370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).