(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide

C18H15NO2 — CID 2146457

IUPAC(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2ccc3ccccc3c2)o1
InChIInChI=1S/C18H15NO2/c1-13-6-9-17(21-13)10-11-18(20)19-16-8-7-14-4-2-3-5-15(14)12-16/h2-12H,1H3,(H,19,20)/b11-10+
InChIKeyDEEFPBGFSYZMPD-ZHACJKMWSA-N
MW277.32 g/mol
LogP4.39
Rot. Bonds3

About (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide

(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide (PubChem CID 2146457) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide
PubChem CID2146457
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide
SMILESCc1ccc(/C=C/C(=O)Nc2ccc3ccccc3c2)o1
InChIInChI=1S/C18H15NO2/c1-13-6-9-17(21-13)10-11-18(20)19-16-8-7-14-4-2-3-5-15(14)12-16/h2-12H,1H3,(H,19,20)/b11-10+
InChIKeyDEEFPBGFSYZMPD-ZHACJKMWSA-N
XLogP4.39
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide 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

(E)-3-(5-methylfuran-2-yl)-N-[3-(phenylcarbamoylamino)phenyl]prop-2-enamide
CID 24632271
(E)-N-(3-hydroxyphenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 78783838
(E)-3-(5-methylfuran-2-yl)-N-[2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]phenyl]prop-2-enamide
CID 1291262
N-(3-chloro-4-fluorophenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 896719
(E)-3-(5-methylfuran-2-yl)-N-(3-methylsulfanylphenyl)prop-2-enamide
CID 2665588
N-(4-bromo-3-chlorophenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 923476
N-(4-acetylphenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 712902
(E)-N-(3,5-dichlorophenyl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 923459
2-fluoro-4-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]benzoic acid
CID 103791438
(E)-3-(5-methylfuran-2-yl)-N-(3-methylsulfonylphenyl)prop-2-enamide
CID 27334787
3-(5-methylfuran-2-yl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
CID 875057
(E)-N-(7-methoxyquinolin-3-yl)-3-(5-methylfuran-2-yl)prop-2-enamide
CID 95745053

Frequently Asked Questions

What is the IUPAC name of (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide?
The IUPAC name of (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide (CID 2146457) is (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide.
What is the SMILES notation for (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide?
The canonical SMILES for (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide is Cc1ccc(/C=C/C(=O)Nc2ccc3ccccc3c2)o1.
What is the InChIKey of (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide?
The InChIKey is DEEFPBGFSYZMPD-ZHACJKMWSA-N. The full InChI is InChI=1S/C18H15NO2/c1-13-6-9-17(21-13)10-11-18(20)19-16-8-7-14-4-2-3-5-15(14)12-16/h2-12H,1H3,(H,19,20)/b11-10+.
What are the key properties of (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide?
(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide has a molecular weight of 277.32 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide is sourced from PubChem (CID 2146457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).