N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide

C21H26N2O4 — CID 86982965

IUPACN-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide
SMILESCCN(CC)C(=O)COc1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C21H26N2O4/c1-4-23(5-2)20(24)15-27-19-11-7-10-18(13-19)22-21(25)17-9-6-8-16(12-17)14-26-3/h6-13H,4-5,14-15H2,1-3H3,(H,22,25)
InChIKeyVZVPZFCMWAEOGS-UHFFFAOYSA-N
MW370.45 g/mol
LogP3.33
Rot. Bonds9

About N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide

N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide (PubChem CID 86982965) has the molecular formula C21H26N2O4 and a molecular weight of 370.45 g/mol. Its IUPAC name is N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide
PubChem CID86982965
Molecular FormulaC21H26N2O4
Molecular Weight370.45 g/mol
Exact Mass370.19
IUPAC NameN-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide
SMILESCCN(CC)C(=O)COc1cccc(NC(=O)c2cccc(COC)c2)c1
InChIInChI=1S/C21H26N2O4/c1-4-23(5-2)20(24)15-27-19-11-7-10-18(13-19)22-21(25)17-9-6-8-16(12-17)14-26-3/h6-13H,4-5,14-15H2,1-3H3,(H,22,25)
InChIKeyVZVPZFCMWAEOGS-UHFFFAOYSA-N
XLogP3.33
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamidophenoxy)-N,N-diethylacetamide
CID 7698145
N-[3-(diethylsulfamoyl)phenyl]-3-(methoxymethyl)benzamide
CID 8777307
3-(methoxymethyl)-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17471157
N-(3-iodophenyl)-3-(methoxymethyl)benzamide
CID 7603133
N-(3-fluorophenyl)-3-(methoxymethyl)benzamide
CID 17462584
N,N-diethyl-3-[[3-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 55996557
6-[[3-[2-(diethylamino)-2-oxoethoxy]phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 119180474
N-[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-ethoxybenzamide
CID 55872621
2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide
CID 33099560
N-[3-[2-[ethyl(2-hydroxyethyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 78861839
3-N,3-N-diethyl-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109055870
3-[2-(dimethylamino)-2-oxoethoxy]-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]benzamide
CID 55777943

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide?
The IUPAC name of N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide (CID 86982965) is N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide?
The canonical SMILES for N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide is CCN(CC)C(=O)COc1cccc(NC(=O)c2cccc(COC)c2)c1.
What is the InChIKey of N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide?
The InChIKey is VZVPZFCMWAEOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O4/c1-4-23(5-2)20(24)15-27-19-11-7-10-18(13-19)22-21(25)17-9-6-8-16(12-17)14-26-3/h6-13H,4-5,14-15H2,1-3H3,(H,22,25).
What are the key properties of N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide?
N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide has a molecular weight of 370.45 g/mol, XLogP of 3.33, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-3-(methoxymethyl)benzamide is sourced from PubChem (CID 86982965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).