N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide

C16H18N2O3 — CID 54824255

IUPACN-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide
SMILESC=CCOc1ccccc1NCC(=O)NCc1ccco1
InChIInChI=1S/C16H18N2O3/c1-2-9-21-15-8-4-3-7-14(15)17-12-16(19)18-11-13-6-5-10-20-13/h2-8,10,17H,1,9,11-12H2,(H,18,19)
InChIKeyWUDWTLHBRNXOJU-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.57
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide

N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide (PubChem CID 54824255) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide
PubChem CID54824255
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide
SMILESC=CCOc1ccccc1NCC(=O)NCc1ccco1
InChIInChI=1S/C16H18N2O3/c1-2-9-21-15-8-4-3-7-14(15)17-12-16(19)18-11-13-6-5-10-20-13/h2-8,10,17H,1,9,11-12H2,(H,18,19)
InChIKeyWUDWTLHBRNXOJU-UHFFFAOYSA-N
XLogP2.57
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide 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

N-(furan-2-ylmethyl)-4-[[2-(2-prop-2-enoxyanilino)acetyl]amino]benzamide
CID 54824228
N-(furan-2-ylmethyl)-2-(4-prop-2-enoxyanilino)acetamide
CID 54821313
2-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)acetamide
CID 54814023
2-(3-chloro-2-methylanilino)-N-(furan-2-ylmethyl)acetamide
CID 31666412
2-(2-fluoroanilino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54818330
N-(furan-2-ylmethylcarbamoyl)-2-(naphthalen-1-ylamino)acetamide
CID 18096502
2-[2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]-2-oxoethoxy]benzamide
CID 9081252
N-(furan-2-ylmethyl)-2-[(N'-methyl-N-prop-2-enylcarbamimidoyl)amino]acetamide
CID 110982703
N,N-diethyl-2-(2-prop-2-enoxyanilino)acetamide
CID 54824487
2-(3,5-dichloroanilino)-N-(furan-2-ylmethyl)acetamide
CID 31666642
N-(furan-2-ylmethyl)-3-[[2-(2-methoxyanilino)acetyl]amino]benzamide
CID 54817531
2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 18118989

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide (CID 54824255) is N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide is C=CCOc1ccccc1NCC(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide?
The InChIKey is WUDWTLHBRNXOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-2-9-21-15-8-4-3-7-14(15)17-12-16(19)18-11-13-6-5-10-20-13/h2-8,10,17H,1,9,11-12H2,(H,18,19).
What are the key properties of N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide?
N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.57, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(2-prop-2-enoxyanilino)acetamide is sourced from PubChem (CID 54824255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).