3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate

C14H16O3 — CID 54289019

IUPAC3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate
SMILESCOc1ccccc1C=CCOC(=O)C1CC1
InChIInChI=1S/C14H16O3/c1-16-13-7-3-2-5-11(13)6-4-10-17-14(15)12-8-9-12/h2-7,12H,8-10H2,1H3
InChIKeyRWEQHBNINNJSOQ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.66
Rot. Bonds5

About 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate

3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate (PubChem CID 54289019) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate.

Molecular Properties

Compound Name3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate
PubChem CID54289019
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate
SMILESCOc1ccccc1C=CCOC(=O)C1CC1
InChIInChI=1S/C14H16O3/c1-16-13-7-3-2-5-11(13)6-4-10-17-14(15)12-8-9-12/h2-7,12H,8-10H2,1H3
InChIKeyRWEQHBNINNJSOQ-UHFFFAOYSA-N
XLogP2.66
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(E)-3-(2-methoxyphenyl)prop-2-enyl]amino]cyclohexane-1-carboxylic acid
CID 120509651
4-(2-methoxyphenyl)but-3-enamide
CID 170797506
1,7-bis(2-methoxyphenyl)hepta-1,6-dien-4-one
CID 140987321
[(E)-3-(2,4,5-trimethoxyphenyl)prop-2-enyl] (E)-3-(2-methoxyphenyl)prop-2-enoate
CID 155530627
3-(4-phenylphenyl)prop-2-enyl cyclopropanecarboxylate
CID 54275232
(E)-3-(2-methoxyphenyl)prop-2-en-1-ol
CID 11400969
(3S)-1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]piperidine-3-carboxamide
CID 30981483
1-methoxy-2-[(E)-3-phenoxyprop-1-enyl]benzene
CID 67215541
N-[3-(2-methoxyphenyl)prop-2-enyl]acetamide
CID 169465048
[(E)-3-(2-methoxyphenyl)prop-2-enyl] phosphono hydrogen phosphate
CID 155543035
[[1-cyclopropyl-3-(2-methoxyphenyl)prop-2-enylidene]amino]urea
CID 165343296
(E)-4-(2-methoxyphenyl)but-3-en-1-ol
CID 15330930

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate?
The IUPAC name of 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate (CID 54289019) is 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate.
What is the SMILES notation for 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate?
The canonical SMILES for 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate is COc1ccccc1C=CCOC(=O)C1CC1.
What is the InChIKey of 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate?
The InChIKey is RWEQHBNINNJSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-16-13-7-3-2-5-11(13)6-4-10-17-14(15)12-8-9-12/h2-7,12H,8-10H2,1H3.
What are the key properties of 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate?
3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate has a molecular weight of 232.28 g/mol, XLogP of 2.66, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)prop-2-enyl cyclopropanecarboxylate is sourced from PubChem (CID 54289019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).