(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol

C15H24O — CID 24796073

IUPAC(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol
SMILESC=C1CC[C@@]2([C@H](C)CC/C=C(/C)CO)C[C@@H]12
InChIInChI=1S/C15H24O/c1-11(10-16)5-4-6-13(3)15-8-7-12(2)14(15)9-15/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5-/t13-,14+,15+/m1/s1
InChIKeyIAANBPBXDASKDC-GQYWAMEOSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds5

About (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol

(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol (PubChem CID 24796073) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol.

Molecular Properties

Compound Name(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol
PubChem CID24796073
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol
SMILESC=C1CC[C@@]2([C@H](C)CC/C=C(/C)CO)C[C@@H]12
InChIInChI=1S/C15H24O/c1-11(10-16)5-4-6-13(3)15-8-7-12(2)14(15)9-15/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5-/t13-,14+,15+/m1/s1
InChIKeyIAANBPBXDASKDC-GQYWAMEOSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
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

(1S,5S)-1-[(2R)-6-methylhept-5-en-2-yl]-4-methylidenebicyclo[3.1.0]hexane
CID 91753589
[2-methyl-6-(4-methylidene-1-bicyclo[3.1.0]hexanyl)hept-2-enyl] acetate
CID 162902767
(1S,2R,4S)-4-[(2S)-7-hydroxy-6-methylhept-5-en-2-yl]-1-methylcyclohexane-1,2,4-triol
CID 170990833
(1S)-1-[(2S)-7-hydroxy-6-methylhept-5-en-2-yl]-4-methylcyclohex-3-en-1-ol
CID 170990830
6-(2,10-dimethyl-13-methylidene-3-oxatetracyclo[10.3.0.02,4.06,10]pentadecan-7-yl)-2-methylhept-2-en-1-ol
CID 163034384
(1S,5S)-4-methyl-1-[(2S)-6-methylhept-5-en-2-yl]bicyclo[3.1.0]hexane
CID 164667457
(Z)-2,6-dimethyloct-2-ene-1,8-diol;methane
CID 175717951
(Z)-2-methyl-5-[(1R,2S,4S)-2-methyl-3-methylidene-7-oxabicyclo[2.2.1]heptan-2-yl]pent-2-en-1-ol
CID 10376273
(E,6S)-6-[(1S,2S,3S,7S)-6,14-dimethylidene-3-tricyclo[8.4.1.02,7]pentadec-10-enyl]-2-methylhept-2-en-1-ol
CID 162991674
2-methyl-5-[(2R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 123863985
2-methyl-5-[(2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 54154316
(Z)-2-methyl-5-[(1R,2S,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
CID 118978202

Frequently Asked Questions

What is the IUPAC name of (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol?
The IUPAC name of (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol (CID 24796073) is (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol.
What is the SMILES notation for (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol?
The canonical SMILES for (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol is C=C1CC[C@@]2([C@H](C)CC/C=C(/C)CO)C[C@@H]12.
What is the InChIKey of (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol?
The InChIKey is IAANBPBXDASKDC-GQYWAMEOSA-N. The full InChI is InChI=1S/C15H24O/c1-11(10-16)5-4-6-13(3)15-8-7-12(2)14(15)9-15/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5-/t13-,14+,15+/m1/s1.
What are the key properties of (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol?
(Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,6R)-2-methyl-6-[(1S,5S)-4-methylidene-1-bicyclo[3.1.0]hexanyl]hept-2-en-1-ol is sourced from PubChem (CID 24796073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).