2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate

C15H20O4 — CID 150652864

IUPAC2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate
SMILESCC(COC(=O)C1=CCCC1)OC(=O)C1=CCCC1
InChIInChI=1S/C15H20O4/c1-11(19-15(17)13-8-4-5-9-13)10-18-14(16)12-6-2-3-7-12/h6,8,11H,2-5,7,9-10H2,1H3
InChIKeyJCGDCMULKVFFFS-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.68
Rot. Bonds5

About 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate

2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate (PubChem CID 150652864) has the molecular formula C15H20O4 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate.

Molecular Properties

Compound Name2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate
PubChem CID150652864
Molecular FormulaC15H20O4
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Name2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate
SMILESCC(COC(=O)C1=CCCC1)OC(=O)C1=CCCC1
InChIInChI=1S/C15H20O4/c1-11(19-15(17)13-8-4-5-9-13)10-18-14(16)12-6-2-3-7-12/h6,8,11H,2-5,7,9-10H2,1H3
InChIKeyJCGDCMULKVFFFS-UHFFFAOYSA-N
XLogP2.68
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dihydroxypropyl cyclodecene-1-carboxylate
CID 175925690
(3-cyano-3-methylbutan-2-yl) cyclopentene-1-carboxylate
CID 71967666
pentyl cyclopentene-1-carboxylate
CID 86197593
hydroxymethyl cyclohexene-1-carboxylate
CID 91001163
prop-2-enoic acid;prop-2-enyl cyclopentene-1-carboxylate
CID 66692212
ethyl (6Z)-1-oxacyclopentadec-6-ene-7-carboxylate
CID 102299212
methyl cyclododecene-1-carboxylate
CID 54564642
2-(4-methoxybenzoyl)oxypropyl 4-methoxybenzoate
CID 90778073
1-(cyclopenten-1-yl)-2,2-diethoxyethanone
CID 55269182
[(2S)-2-benzoyloxypropyl] benzoate
CID 73416127
2-(cyclohexene-1-carbonyloxy)ethyl benzoate
CID 90721732
stibanyl cyclohexene-1-carboxylate
CID 174261272

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate?
The IUPAC name of 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate (CID 150652864) is 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate.
What is the SMILES notation for 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate?
The canonical SMILES for 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate is CC(COC(=O)C1=CCCC1)OC(=O)C1=CCCC1.
What is the InChIKey of 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate?
The InChIKey is JCGDCMULKVFFFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O4/c1-11(19-15(17)13-8-4-5-9-13)10-18-14(16)12-6-2-3-7-12/h6,8,11H,2-5,7,9-10H2,1H3.
What are the key properties of 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate?
2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 2.68, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentene-1-carbonyloxy)propyl cyclopentene-1-carboxylate is sourced from PubChem (CID 150652864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).