furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate

C18H14O3 — CID 801603

IUPACfuran-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate
SMILESO=C(C=Cc1ccc2ccccc2c1)OCc1ccco1
InChIInChI=1S/C18H14O3/c19-18(21-13-17-6-3-11-20-17)10-8-14-7-9-15-4-1-2-5-16(15)12-14/h1-12H,13H2
InChIKeyWSFZKGKOHAGZLI-UHFFFAOYSA-N
MW278.31 g/mol
LogP4.19
Rot. Bonds4

About furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate

furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate (PubChem CID 801603) has the molecular formula C18H14O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate.

Molecular Properties

Compound Namefuran-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate
PubChem CID801603
Molecular FormulaC18H14O3
Molecular Weight278.31 g/mol
Exact Mass278.09
IUPAC Namefuran-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate
SMILESO=C(C=Cc1ccc2ccccc2c1)OCc1ccco1
InChIInChI=1S/C18H14O3/c19-18(21-13-17-6-3-11-20-17)10-8-14-7-9-15-4-1-2-5-16(15)12-14/h1-12H,13H2
InChIKeyWSFZKGKOHAGZLI-UHFFFAOYSA-N
XLogP4.19
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-4-(furan-2-ylmethoxy)-4-oxobut-2-enoic acid
CID 13045444
2-phenylethyl (E)-3-naphthalen-2-ylprop-2-enoate
CID 138558211
furan-2-ylmethyl pent-2-enoate
CID 140682231
1,7-dinaphthalen-2-ylhepta-1,6-diene-3,5-dione
CID 86098447
furan-2-ylmethyl prop-2-enoate;hydron
CID 174819627
methyl (E)-3-anthracen-2-ylprop-2-enoate
CID 87861616
ethyl 3-(6-hydroxynaphthalen-2-yl)prop-2-enoate
CID 131876701
(E)-N-[2-(furan-2-yl)ethyl]-3-(6-methoxynaphthalen-2-yl)prop-2-enamide
CID 9184707
(E)-3-naphthalen-2-ylprop-2-enehydrazide
CID 70290410
furan-2-ylmethyl (Z)-3-phenyl-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate
CID 45069052
(5-hydroxy-4-oxopyran-2-yl)methyl (E)-3-(3-hydroxyphenyl)prop-2-enoate
CID 138857538
(4-methylphenyl)methyl (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate
CID 7740353

Frequently Asked Questions

What is the IUPAC name of furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate?
The IUPAC name of furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate (CID 801603) is furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate.
What is the SMILES notation for furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate?
The canonical SMILES for furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate is O=C(C=Cc1ccc2ccccc2c1)OCc1ccco1.
What is the InChIKey of furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate?
The InChIKey is WSFZKGKOHAGZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O3/c19-18(21-13-17-6-3-11-20-17)10-8-14-7-9-15-4-1-2-5-16(15)12-14/h1-12H,13H2.
What are the key properties of furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate?
furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate has a molecular weight of 278.31 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-ylmethyl 3-naphthalen-2-ylprop-2-enoate is sourced from PubChem (CID 801603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).