4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide

C13H14N2O2 — CID 104694164

IUPAC4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide
SMILESNCc1ccc(C(=O)NCc2ccoc2)cc1
InChIInChI=1S/C13H14N2O2/c14-7-10-1-3-12(4-2-10)13(16)15-8-11-5-6-17-9-11/h1-6,9H,7-8,14H2,(H,15,16)
InChIKeyLLOBXTFTZFDLQC-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.67
Rot. Bonds4

About 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide

4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide (PubChem CID 104694164) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide
PubChem CID104694164
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide
SMILESNCc1ccc(C(=O)NCc2ccoc2)cc1
InChIInChI=1S/C13H14N2O2/c14-7-10-1-3-12(4-2-10)13(16)15-8-11-5-6-17-9-11/h1-6,9H,7-8,14H2,(H,15,16)
InChIKeyLLOBXTFTZFDLQC-UHFFFAOYSA-N
XLogP1.67
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide 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-3-ylmethyl)-4-hydroxybenzamide
CID 115870248
4-(aminomethyl)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107229542
N-[[4-(aminomethyl)phenyl]methyl]-4-ethylbenzamide
CID 60918762
4-[(1,3-dioxoisoindol-2-yl)methyl]-N-(furan-3-ylmethyl)benzamide
CID 55838537
4-(aminomethyl)-N-[[3-(hydroxymethyl)phenyl]methyl]benzamide
CID 103796375
N-(furan-3-ylmethyl)-4-(phenylsulfamoyl)benzamide
CID 55700082
4-[(furan-3-ylmethylamino)methyl]benzamide
CID 47272463
4-(cyclopentylsulfamoyl)-N-(furan-3-ylmethyl)benzamide
CID 70751779
2-(4-fluorophenyl)-N-(furan-3-ylmethyl)acetamide
CID 47285310
3-bromo-N-(furan-3-ylmethyl)-4-methoxybenzamide
CID 47034242
N-[[4-(aminomethyl)phenyl]methyl]-4-ethoxybenzamide
CID 60918064
4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide?
The IUPAC name of 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide (CID 104694164) is 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide?
The canonical SMILES for 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide is NCc1ccc(C(=O)NCc2ccoc2)cc1.
What is the InChIKey of 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide?
The InChIKey is LLOBXTFTZFDLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c14-7-10-1-3-12(4-2-10)13(16)15-8-11-5-6-17-9-11/h1-6,9H,7-8,14H2,(H,15,16).
What are the key properties of 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide?
4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide has a molecular weight of 230.27 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-(furan-3-ylmethyl)benzamide is sourced from PubChem (CID 104694164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).