1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene

C19H30O2 — CID 141361132

IUPAC1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene
SMILESCOCC1(COC)C=CC(C2CCCC2)=C1C1CCCC1
InChIInChI=1S/C19H30O2/c1-20-13-19(14-21-2)12-11-17(15-7-3-4-8-15)18(19)16-9-5-6-10-16/h11-12,15-16H,3-10,13-14H2,1-2H3
InChIKeyLJFDNMVGTKKACR-UHFFFAOYSA-N
MW290.45 g/mol
LogP4.51
Rot. Bonds6

About 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene

1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene (PubChem CID 141361132) has the molecular formula C19H30O2 and a molecular weight of 290.45 g/mol. Its IUPAC name is 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene
PubChem CID141361132
Molecular FormulaC19H30O2
Molecular Weight290.45 g/mol
Exact Mass290.22
IUPAC Name1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene
SMILESCOCC1(COC)C=CC(C2CCCC2)=C1C1CCCC1
InChIInChI=1S/C19H30O2/c1-20-13-19(14-21-2)12-11-17(15-7-3-4-8-15)18(19)16-9-5-6-10-16/h11-12,15-16H,3-10,13-14H2,1-2H3
InChIKeyLJFDNMVGTKKACR-UHFFFAOYSA-N
XLogP4.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,5-Bis(methoxymethyl)-1-methyl-2-propan-2-yl-3-prop-1-enylidenecyclohexene
CID 101726765
(4E)-1,1-bis(methoxymethyl)-3-[(2Z)-penta-2,4-dienyl]-4-propylidenecyclopentane
CID 102356670
1,1-Bis(methoxymethyl)-4,7-dimethyl-4,5,6,7-tetrahydroindene
CID 22140514
2,3-Dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene
CID 53919119
Cyclopenta-1,3-diene;3-cyclopentyl-1,1-bis(methoxymethyl)cyclopentane
CID 174746399

Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene?
The IUPAC name of 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene (CID 141361132) is 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene.
What is the SMILES notation for 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene?
The canonical SMILES for 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene is COCC1(COC)C=CC(C2CCCC2)=C1C1CCCC1.
What is the InChIKey of 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene?
The InChIKey is LJFDNMVGTKKACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30O2/c1-20-13-19(14-21-2)12-11-17(15-7-3-4-8-15)18(19)16-9-5-6-10-16/h11-12,15-16H,3-10,13-14H2,1-2H3.
What are the key properties of 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene?
1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene has a molecular weight of 290.45 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclopentyl-5,5-bis(methoxymethyl)cyclopenta-1,3-diene is sourced from PubChem (CID 141361132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).