(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol

C15H24O — CID 163074958

IUPAC(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol
SMILESC=C(C)[C@H]1CC/C(C)=C\CCC(=C)[C@@H](O)C1
InChIInChI=1S/C15H24O/c1-11(2)14-9-8-12(3)6-5-7-13(4)15(16)10-14/h6,14-16H,1,4-5,7-10H2,2-3H3/b12-6-/t14-,15-/m0/s1
InChIKeyFCDRTOJMUHXAJJ-JAHBZWGTSA-N
MW220.36 g/mol
LogP4.01
Rot. Bonds1

About (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol

(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol (PubChem CID 163074958) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol.

Molecular Properties

Compound Name(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol
PubChem CID163074958
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol
SMILESC=C(C)[C@H]1CC/C(C)=C\CCC(=C)[C@@H](O)C1
InChIInChI=1S/C15H24O/c1-11(2)14-9-8-12(3)6-5-7-13(4)15(16)10-14/h6,14-16H,1,4-5,7-10H2,2-3H3/b12-6-/t14-,15-/m0/s1
InChIKeyFCDRTOJMUHXAJJ-JAHBZWGTSA-N
XLogP4.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.01
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

(1R,7R)-4,10-dimethyl-14-methylidene-7-prop-1-en-2-ylcyclotetradeca-4,10-dien-1-ol
CID 162887924
(1S,3R,5Z,9R)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-ene-1,3-diol
CID 102066424
(1E,5E,8R,10R)-1,5-dimethyl-8,10-bis(prop-1-en-2-yl)cyclododeca-1,5-diene
CID 14192378
(1S,5Z,9R)-6-methyl-9-(6-methylhepta-1,5-dien-2-yl)-2-methylidenecyclodec-5-en-1-ol
CID 162905191
acetic acid;cis-(1S,5R)-2-methylidene-5-prop-1-en-2-ylcyclohexan-1-ol
CID 170839757
(1R,5Z,9S)-9-[(2E,4E)-6-hydroxy-6-methylhepta-2,4-dien-2-yl]-6-methyl-2-methylidenecyclodec-5-en-1-ol
CID 162865550
(1S,2Z,6Z,10E,13S)-2,6,10-trimethyl-13-prop-1-en-2-ylcyclotetradeca-2,6,10-trien-1-ol
CID 10266146
1,5,9-trimethyl-12-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,8-diene
CID 73209089
(3E,7E)-3,7-dimethyl-11-methylidenecycloundeca-3,7-dien-1-ol
CID 25209926
5-methylcyclooct-5-ene-1,2-diol
CID 68741308
1-[(1R,3R)-3-hydroxy-4-methylidenecyclohexyl]ethanone
CID 15600203
ethane-1,2-diol;1-methyl-4-prop-1-en-2-ylcyclohexene
CID 67811623

Frequently Asked Questions

What is the IUPAC name of (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol?
The IUPAC name of (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol (CID 163074958) is (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol.
What is the SMILES notation for (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol?
The canonical SMILES for (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol is C=C(C)[C@H]1CC/C(C)=C\CCC(=C)[C@@H](O)C1.
What is the InChIKey of (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol?
The InChIKey is FCDRTOJMUHXAJJ-JAHBZWGTSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)14-9-8-12(3)6-5-7-13(4)15(16)10-14/h6,14-16H,1,4-5,7-10H2,2-3H3/b12-6-/t14-,15-/m0/s1.
What are the key properties of (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol?
(1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol has a molecular weight of 220.36 g/mol, XLogP of 4.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5Z,9S)-6-methyl-2-methylidene-9-prop-1-en-2-ylcyclodec-5-en-1-ol is sourced from PubChem (CID 163074958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).