(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide

C14H13NO3 — CID 2303040

IUPAC(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1NC(=O)/C=C\c1ccco1
InChIInChI=1S/C14H13NO3/c1-17-13-7-3-2-6-12(13)15-14(16)9-8-11-5-4-10-18-11/h2-10H,1H3,(H,15,16)/b9-8-
InChIKeyDSLKZOZKZHXIRE-HJWRWDBZSA-N
MW243.26 g/mol
LogP2.94
Rot. Bonds4

About (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide

(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide (PubChem CID 2303040) has the molecular formula C14H13NO3 and a molecular weight of 243.26 g/mol. Its IUPAC name is (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide
PubChem CID2303040
Molecular FormulaC14H13NO3
Molecular Weight243.26 g/mol
Exact Mass243.09
IUPAC Name(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1NC(=O)/C=C\c1ccco1
InChIInChI=1S/C14H13NO3/c1-17-13-7-3-2-6-12(13)15-14(16)9-8-11-5-4-10-18-11/h2-10H,1H3,(H,15,16)/b9-8-
InChIKeyDSLKZOZKZHXIRE-HJWRWDBZSA-N
XLogP2.94
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 52.94
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 (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide?
The IUPAC name of (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide (CID 2303040) is (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide.
What is the SMILES notation for (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide?
The canonical SMILES for (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide is COc1ccccc1NC(=O)/C=C\c1ccco1.
What is the InChIKey of (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide?
The InChIKey is DSLKZOZKZHXIRE-HJWRWDBZSA-N. The full InChI is InChI=1S/C14H13NO3/c1-17-13-7-3-2-6-12(13)15-14(16)9-8-11-5-4-10-18-11/h2-10H,1H3,(H,15,16)/b9-8-.
What are the key properties of (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide?
(Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide has a molecular weight of 243.26 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(furan-2-yl)-N-(2-methoxyphenyl)prop-2-enamide is sourced from PubChem (CID 2303040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).