(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene

C15H24 — CID 162874249

IUPAC(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene
SMILESC=C1/C=C/C[C@@H](C(C)C)CC/C(C)=C/C1
InChIInChI=1S/C15H24/c1-12(2)15-7-5-6-13(3)8-9-14(4)10-11-15/h5-6,9,12,15H,3,7-8,10-11H2,1-2,4H3/b6-5+,14-9+/t15-/m1/s1
InChIKeyOVVBIIZBHVVFQY-NLXVAFRTSA-N
MW204.36 g/mol
LogP4.89
Rot. Bonds1

About (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene

(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene (PubChem CID 162874249) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene.

Molecular Properties

Compound Name(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene
PubChem CID162874249
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene
SMILESC=C1/C=C/C[C@@H](C(C)C)CC/C(C)=C/C1
InChIInChI=1S/C15H24/c1-12(2)15-7-5-6-13(3)8-9-14(4)10-11-15/h5-6,9,12,15H,3,7-8,10-11H2,1-2,4H3/b6-5+,14-9+/t15-/m1/s1
InChIKeyOVVBIIZBHVVFQY-NLXVAFRTSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-methylidene-5-propan-2-ylcyclohexene
CID 149039202
(1E,5E,9E)-1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-1,5,9-triene
CID 171904454
1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-1,5,9-triene
CID 75094485
(2S)-2-[(1R)-4-methylcyclohex-3-en-1-yl]propanal
CID 76958477
(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene
CID 6436582
(4R,5R)-1,5-dimethyl-4-propan-2-ylcyclohexene;(4R,5S)-1,5-dimethyl-4-propan-2-ylcyclohexene;(4S,5R)-1,5-dimethyl-4-propan-2-ylcyclohexene;(4S,5S)-1,5-dimethyl-4-propan-2-ylcyclohexene;1-methyl-4-propan-2-ylcyclohexane;(4R)-1-methyl-4-propan-2-ylcyclohexene;(4S)-1-methyl-4-propan-2-ylcyclohexene
CID 160741124
(1E,5E,10E,12R)-1,5-dimethyl-9-methylidene-12-propan-2-ylcyclotetradeca-1,5,10-triene
CID 177497570
(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene
CID 165345238
(4-propan-2-ylcyclohexen-1-yl)oxidanium
CID 163435891
3-[(1S)-4-methylcyclohex-3-en-1-yl]butanal
CID 130643882
2-(4-methylcyclohex-3-en-1-yl)propane-1-thiol
CID 59610016
CID 10458509
CID 10458509

Frequently Asked Questions

What is the IUPAC name of (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene?
The IUPAC name of (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene (CID 162874249) is (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene.
What is the SMILES notation for (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene?
The canonical SMILES for (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene is C=C1/C=C/C[C@@H](C(C)C)CC/C(C)=C/C1.
What is the InChIKey of (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene?
The InChIKey is OVVBIIZBHVVFQY-NLXVAFRTSA-N. The full InChI is InChI=1S/C15H24/c1-12(2)15-7-5-6-13(3)8-9-14(4)10-11-15/h5-6,9,12,15H,3,7-8,10-11H2,1-2,4H3/b6-5+,14-9+/t15-/m1/s1.
What are the key properties of (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene?
(1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene has a molecular weight of 204.36 g/mol, XLogP of 4.89, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,5E,8S)-1-methyl-4-methylidene-8-propan-2-ylcyclodeca-1,5-diene is sourced from PubChem (CID 162874249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).