N,N-diethyl-2-(3-methoxyphenyl)benzamide

C18H21NO2 — CID 71059176

IUPACN,N-diethyl-2-(3-methoxyphenyl)benzamide
SMILESCCN(CC)C(=O)c1ccccc1-c1cccc(OC)c1
InChIInChI=1S/C18H21NO2/c1-4-19(5-2)18(20)17-12-7-6-11-16(17)14-9-8-10-15(13-14)21-3/h6-13H,4-5H2,1-3H3
InChIKeyWWCFRWMKJNKEFR-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.84
Rot. Bonds5

About N,N-diethyl-2-(3-methoxyphenyl)benzamide

N,N-diethyl-2-(3-methoxyphenyl)benzamide (PubChem CID 71059176) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N,N-diethyl-2-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound NameN,N-diethyl-2-(3-methoxyphenyl)benzamide
PubChem CID71059176
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN,N-diethyl-2-(3-methoxyphenyl)benzamide
SMILESCCN(CC)C(=O)c1ccccc1-c1cccc(OC)c1
InChIInChI=1S/C18H21NO2/c1-4-19(5-2)18(20)17-12-7-6-11-16(17)14-9-8-10-15(13-14)21-3/h6-13H,4-5H2,1-3H3
InChIKeyWWCFRWMKJNKEFR-UHFFFAOYSA-N
XLogP3.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(3-methoxyphenyl)benzamide?
The IUPAC name of N,N-diethyl-2-(3-methoxyphenyl)benzamide (CID 71059176) is N,N-diethyl-2-(3-methoxyphenyl)benzamide.
What is the SMILES notation for N,N-diethyl-2-(3-methoxyphenyl)benzamide?
The canonical SMILES for N,N-diethyl-2-(3-methoxyphenyl)benzamide is CCN(CC)C(=O)c1ccccc1-c1cccc(OC)c1.
What is the InChIKey of N,N-diethyl-2-(3-methoxyphenyl)benzamide?
The InChIKey is WWCFRWMKJNKEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-4-19(5-2)18(20)17-12-7-6-11-16(17)14-9-8-10-15(13-14)21-3/h6-13H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-2-(3-methoxyphenyl)benzamide?
N,N-diethyl-2-(3-methoxyphenyl)benzamide has a molecular weight of 283.37 g/mol, XLogP of 3.84, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 71059176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).