N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide

C17H20N2O2 — CID 61376120

IUPACN-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)NCc1cccc(COC)c1
InChIInChI=1S/C17H20N2O2/c1-18-16-9-4-3-8-15(16)17(20)19-11-13-6-5-7-14(10-13)12-21-2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyWUPNUFAJORWSRC-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.80
Rot. Bonds6

About N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide

N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide (PubChem CID 61376120) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide
PubChem CID61376120
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)NCc1cccc(COC)c1
InChIInChI=1S/C17H20N2O2/c1-18-16-9-4-3-8-15(16)17(20)19-11-13-6-5-7-14(10-13)12-21-2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyWUPNUFAJORWSRC-UHFFFAOYSA-N
XLogP2.80
TPSA50.36 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 ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methoxymethyl)-N-[[3-[[[2-(methoxymethyl)benzoyl]amino]methyl]phenyl]methyl]benzamide
CID 121289726
2,5-dibromo-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
CID 114371778
2-(methylamino)-N-[(4-methylphenyl)methyl]benzamide
CID 4080899
2-bromo-N-[[3-(methoxymethyl)phenyl]methyl]-5-methylbenzamide
CID 80973519
5-amino-2-fluoro-N-[[3-(methoxymethyl)phenyl]methyl]benzamide
CID 61138112
N-[[3-(methoxymethyl)phenyl]methyl]-2-(trifluoromethylsulfanyl)pyridine-3-carboxamide
CID 47856181
2-(methylamino)-N-(1H-pyrazol-4-ylmethyl)benzamide
CID 61375925
N-[[3-(methoxymethyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 46487608
N-[[4-(dimethylamino)phenyl]methyl]-2-(methylamino)benzamide
CID 61378453
2-bromo-N-[[3-(methoxymethyl)phenyl]methyl]pyridine-4-carboxamide
CID 103752430
3-amino-N-[[3-(methoxymethyl)phenyl]methyl]propanamide
CID 61004060
2-[(4-methoxybenzoyl)amino]-N-[[3-(methylsulfamoyl)phenyl]methyl]benzamide
CID 55656448

Frequently Asked Questions

What is the IUPAC name of N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide?
The IUPAC name of N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide (CID 61376120) is N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide.
What is the SMILES notation for N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide?
The canonical SMILES for N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide is CNc1ccccc1C(=O)NCc1cccc(COC)c1.
What is the InChIKey of N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide?
The InChIKey is WUPNUFAJORWSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-18-16-9-4-3-8-15(16)17(20)19-11-13-6-5-7-14(10-13)12-21-2/h3-10,18H,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide?
N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(methoxymethyl)phenyl]methyl]-2-(methylamino)benzamide is sourced from PubChem (CID 61376120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).