5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide

C13H14N2O3 — CID 113228275

IUPAC5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide
SMILESCOc1ccc(N)cc1C(=O)NCc1ccoc1
InChIInChI=1S/C13H14N2O3/c1-17-12-3-2-10(14)6-11(12)13(16)15-7-9-4-5-18-8-9/h2-6,8H,7,14H2,1H3,(H,15,16)
InChIKeyYASFFQHIJSFLJQ-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.80
Rot. Bonds4

About 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide

5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide (PubChem CID 113228275) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide.

Molecular Properties

Compound Name5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide
PubChem CID113228275
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide
SMILESCOc1ccc(N)cc1C(=O)NCc1ccoc1
InChIInChI=1S/C13H14N2O3/c1-17-12-3-2-10(14)6-11(12)13(16)15-7-9-4-5-18-8-9/h2-6,8H,7,14H2,1H3,(H,15,16)
InChIKeyYASFFQHIJSFLJQ-UHFFFAOYSA-N
XLogP1.80
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide 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

5-amino-N-[[4-(hydroxymethyl)phenyl]methyl]-2-methoxybenzamide
CID 107229452
5-amino-N-[(4-bromophenyl)methyl]-2-methoxybenzamide
CID 61090611
5-amino-2-methoxy-N-[(3-methylphenyl)methyl]benzamide
CID 61103300
5-amino-2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 63304703
3-bromo-N-(furan-3-ylmethyl)-4-methoxybenzamide
CID 47034242
5-amino-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 61093193
5-amino-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-methoxybenzamide
CID 106368719
2-bromo-N-(furan-3-ylmethyl)-5-methoxybenzamide
CID 47204815
5-amino-2-methoxy-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]benzamide
CID 61141152
tert-butyl N-[2-[(5-amino-2-methoxybenzoyl)amino]ethyl]carbamate
CID 104932681
5-amino-2-methoxy-N-(1,3-thiazol-4-ylmethyl)benzamide
CID 63830021
methyl 5-[(furan-3-carbonylamino)methyl]-2-methoxybenzoate
CID 51265623

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide?
The IUPAC name of 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide (CID 113228275) is 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide.
What is the SMILES notation for 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide?
The canonical SMILES for 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide is COc1ccc(N)cc1C(=O)NCc1ccoc1.
What is the InChIKey of 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide?
The InChIKey is YASFFQHIJSFLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-17-12-3-2-10(14)6-11(12)13(16)15-7-9-4-5-18-8-9/h2-6,8H,7,14H2,1H3,(H,15,16).
What are the key properties of 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide?
5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide has a molecular weight of 246.27 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(furan-3-ylmethyl)-2-methoxybenzamide is sourced from PubChem (CID 113228275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).