ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate

C15H14O3 — CID 170872169

IUPACethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate
SMILESCCOC(=O)/C(=C\c1ccco1)c1ccccc1
InChIInChI=1S/C15H14O3/c1-2-17-15(16)14(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-11H,2H2,1H3/b14-11-
InChIKeyGMRFFGUVEKPVLE-KAMYIIQDSA-N
MW242.27 g/mol
LogP3.38
Rot. Bonds4

About ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate

ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate (PubChem CID 170872169) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate.

Molecular Properties

Compound Nameethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate
PubChem CID170872169
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Nameethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate
SMILESCCOC(=O)/C(=C\c1ccco1)c1ccccc1
InChIInChI=1S/C15H14O3/c1-2-17-15(16)14(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-11H,2H2,1H3/b14-11-
InChIKeyGMRFFGUVEKPVLE-KAMYIIQDSA-N
XLogP3.38
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate 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

3-(furan-2-yl)-2-phenylprop-2-enamide
CID 1281215
3-ethoxycarbonyl-4-(furan-2-yl)but-3-enoic acid
CID 71362609
ethyl (E)-4-oxo-2-phenylbut-2-enoate
CID 122364112
ethyl (Z)-3-hydroxy-2-phenylprop-2-enoate
CID 12898650
ethyl (Z)-3-amino-2-phenylprop-2-enoate
CID 168921248
ethyl (Z)-2-cyano-3-(furan-2-yl)prop-2-enoate
CID 5337852
ethyl 2-phenylpent-2-enoate
CID 148550128
ethyl (E)-2-phenyl-3-pyridin-4-ylprop-2-enoate
CID 71746947
diethyl 2-hydroxy-5-phenylhexa-2,4-dienedioate
CID 54729638
ethyl 4,4-diethoxy-2-(furan-2-ylmethylidene)-3-oxobutanoate
CID 70073300
ethyl (Z)-3-[tert-butyl(dimethyl)silyl]oxy-2-phenylprop-2-enoate
CID 11844681
(E)-3-(furan-2-yl)-N-(3-methylbutyl)-2-phenylprop-2-enamide
CID 6389358

Frequently Asked Questions

What is the IUPAC name of ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate?
The IUPAC name of ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate (CID 170872169) is ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate.
What is the SMILES notation for ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate?
The canonical SMILES for ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate is CCOC(=O)/C(=C\c1ccco1)c1ccccc1.
What is the InChIKey of ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate?
The InChIKey is GMRFFGUVEKPVLE-KAMYIIQDSA-N. The full InChI is InChI=1S/C15H14O3/c1-2-17-15(16)14(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-11H,2H2,1H3/b14-11-.
What are the key properties of ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate?
ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate has a molecular weight of 242.27 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (Z)-3-(furan-2-yl)-2-phenylprop-2-enoate is sourced from PubChem (CID 170872169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).