4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide

C17H20N2O2 — CID 60924658

IUPAC4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
SMILESCOCc1ccccc1CNC(=O)c1ccc(CN)cc1
InChIInChI=1S/C17H20N2O2/c1-21-12-16-5-3-2-4-15(16)11-19-17(20)14-8-6-13(10-18)7-9-14/h2-9H,10-12,18H2,1H3,(H,19,20)
InChIKeyHBYCPNYDGLVHBH-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.22
Rot. Bonds6

About 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide

4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide (PubChem CID 60924658) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
PubChem CID60924658
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
SMILESCOCc1ccccc1CNC(=O)c1ccc(CN)cc1
InChIInChI=1S/C17H20N2O2/c1-21-12-16-5-3-2-4-15(16)11-19-17(20)14-8-6-13(10-18)7-9-14/h2-9H,10-12,18H2,1H3,(H,19,20)
InChIKeyHBYCPNYDGLVHBH-UHFFFAOYSA-N
XLogP2.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602161
N-[[2-(methoxymethyl)phenyl]methyl]-4-pyrrol-1-ylbenzamide
CID 32603825
N-[[2-(aminomethyl)phenyl]methyl]-4-ethylbenzamide
CID 62950627
3-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602369
N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide
CID 34684530
3-fluoro-N-[[2-(methoxymethyl)phenyl]methyl]-4-methylbenzamide
CID 32604559
2-(4-fluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]acetamide
CID 33065353
N-[[2-(methoxymethyl)phenyl]methyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 32604555
N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762844
2,3-difluoro-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 62649576
N-[[2-(aminomethyl)phenyl]methyl]-4-ethoxybenzamide
CID 62952156
4-(methoxymethyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]benzamide
CID 9481322

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide?
The IUPAC name of 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide (CID 60924658) is 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide?
The canonical SMILES for 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide is COCc1ccccc1CNC(=O)c1ccc(CN)cc1.
What is the InChIKey of 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide?
The InChIKey is HBYCPNYDGLVHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-21-12-16-5-3-2-4-15(16)11-19-17(20)14-8-6-13(10-18)7-9-14/h2-9H,10-12,18H2,1H3,(H,19,20).
What are the key properties of 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide?
4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 60924658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).