2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate

C15H20O3 — CID 69462579

IUPAC2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate
SMILESO=C(OCCO)/C(=C\C1=CCCC1)C1=CCCC1
InChIInChI=1S/C15H20O3/c16-9-10-18-15(17)14(13-7-3-4-8-13)11-12-5-1-2-6-12/h5,7,11,16H,1-4,6,8-10H2/b14-11-
InChIKeySYLISYURCOCYQS-KAMYIIQDSA-N
MW248.32 g/mol
LogP2.67
Rot. Bonds5

About 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate

2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate (PubChem CID 69462579) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate.

Molecular Properties

Compound Name2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate
PubChem CID69462579
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Name2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate
SMILESO=C(OCCO)/C(=C\C1=CCCC1)C1=CCCC1
InChIInChI=1S/C15H20O3/c16-9-10-18-15(17)14(13-7-3-4-8-13)11-12-5-1-2-6-12/h5,7,11,16H,1-4,6,8-10H2/b14-11-
InChIKeySYLISYURCOCYQS-KAMYIIQDSA-N
XLogP2.67
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate?
The IUPAC name of 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate (CID 69462579) is 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate.
What is the SMILES notation for 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate?
The canonical SMILES for 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate is O=C(OCCO)/C(=C\C1=CCCC1)C1=CCCC1.
What is the InChIKey of 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate?
The InChIKey is SYLISYURCOCYQS-KAMYIIQDSA-N. The full InChI is InChI=1S/C15H20O3/c16-9-10-18-15(17)14(13-7-3-4-8-13)11-12-5-1-2-6-12/h5,7,11,16H,1-4,6,8-10H2/b14-11-.
What are the key properties of 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate?
2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate has a molecular weight of 248.32 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl (Z)-2,3-di(cyclopenten-1-yl)prop-2-enoate is sourced from PubChem (CID 69462579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).