2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene

C12H14O — CID 135850354

IUPAC2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene
SMILESC1=CC(COCC2=CCC=C2)C=C1
InChIInChI=1S/C12H14O/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-12/h1-3,5-8,11H,4,9-10H2
InChIKeyLTQCACQZVVDJHC-UHFFFAOYSA-N
MW174.24 g/mol
LogP2.63
Rot. Bonds4

About 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene

2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene (PubChem CID 135850354) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene
PubChem CID135850354
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene
SMILESC1=CC(COCC2=CCC=C2)C=C1
InChIInChI=1S/C12H14O/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-12/h1-3,5-8,11H,4,9-10H2
InChIKeyLTQCACQZVVDJHC-UHFFFAOYSA-N
XLogP2.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(2-cyclopenta-1,4-dien-1-ylethoxy)ethyl]cyclopenta-1,3-diene
CID 15841181
cyclopenta-1,4-dien-1-ylmethoxy(trimethyl)silane
CID 22555170
cyclopenta-1,4-dien-1-ylmethyl N-methylcarbamate
CID 134109882
2-(2-bromoethyl)cyclopenta-1,3-diene
CID 91385772
ethane;2-propylcyclopenta-1,3-diene
CID 142052577
2-(3-cyclopenta-1,4-dien-1-yl-2,2-dimethylpropyl)cyclopenta-1,3-diene
CID 87447368
2-(methylsulfanylmethyl)cyclopenta-1,3-diene
CID 22555406
cyclohepta-1,4,6-trien-1-ylmethyl hydrogen carbonate
CID 143297342
2-(2,2-dimethylpropyl)cyclopenta-1,3-diene;zirconium
CID 175034285
ethane;2-prop-2-enylcyclopenta-1,3-diene
CID 142584278
1-(cyclopenta-1,4-dien-1-ylmethyl)-4-methylpiperidine
CID 90811992
5-(6-iodohexoxymethyl)cyclopenta-1,3-diene
CID 102072853

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene?
The IUPAC name of 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene (CID 135850354) is 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene.
What is the SMILES notation for 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene?
The canonical SMILES for 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene is C1=CC(COCC2=CCC=C2)C=C1.
What is the InChIKey of 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene?
The InChIKey is LTQCACQZVVDJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O/c1-2-6-11(5-1)9-13-10-12-7-3-4-8-12/h1-3,5-8,11H,4,9-10H2.
What are the key properties of 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene?
2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene has a molecular weight of 174.24 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenta-2,4-dien-1-ylmethoxymethyl)cyclopenta-1,3-diene is sourced from PubChem (CID 135850354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).