(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene

C15H22 — CID 165345238

IUPAC(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene
SMILESC=C1/C=C\CC(=C)/C=C/[C@H](C(C)C)CC1
InChIInChI=1S/C15H22/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h5-6,9,11-12,15H,3-4,7-8,10H2,1-2H3/b6-5-,11-9+/t15-/m1/s1
InChIKeyLPHFTGHLBGIXRI-AEAFYJBASA-N
MW202.34 g/mol
LogP4.67
Rot. Bonds1

About (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene

(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene (PubChem CID 165345238) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene.

Molecular Properties

Compound Name(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene
PubChem CID165345238
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene
SMILESC=C1/C=C\CC(=C)/C=C/[C@H](C(C)C)CC1
InChIInChI=1S/C15H22/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h5-6,9,11-12,15H,3-4,7-8,10H2,1-2H3/b6-5-,11-9+/t15-/m1/s1
InChIKeyLPHFTGHLBGIXRI-AEAFYJBASA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene?
The IUPAC name of (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene (CID 165345238) is (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene.
What is the SMILES notation for (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene?
The canonical SMILES for (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene is C=C1/C=C\CC(=C)/C=C/[C@H](C(C)C)CC1.
What is the InChIKey of (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene?
The InChIKey is LPHFTGHLBGIXRI-AEAFYJBASA-N. The full InChI is InChI=1S/C15H22/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h5-6,9,11-12,15H,3-4,7-8,10H2,1-2H3/b6-5-,11-9+/t15-/m1/s1.
What are the key properties of (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene?
(1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene has a molecular weight of 202.34 g/mol, XLogP of 4.67, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,5Z,10S)-3,7-dimethylidene-10-propan-2-ylcyclodeca-1,5-diene is sourced from PubChem (CID 165345238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).