N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide

C19H22N2O2 — CID 737730

IUPACN-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide
SMILESCCN(CC)C(=O)c1ccccc1NC(=O)c1ccccc1C
InChIInChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-12-8-9-13-17(16)20-18(22)15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,20,22)
InChIKeyOLQHLCXWFPBFDX-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.73
Rot. Bonds5

About N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide

N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide (PubChem CID 737730) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide
PubChem CID737730
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide
SMILESCCN(CC)C(=O)c1ccccc1NC(=O)c1ccccc1C
InChIInChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-12-8-9-13-17(16)20-18(22)15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,20,22)
InChIKeyOLQHLCXWFPBFDX-UHFFFAOYSA-N
XLogP3.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide?
The IUPAC name of N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide (CID 737730) is N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide.
What is the SMILES notation for N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide?
The canonical SMILES for N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide is CCN(CC)C(=O)c1ccccc1NC(=O)c1ccccc1C.
What is the InChIKey of N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide?
The InChIKey is OLQHLCXWFPBFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-12-8-9-13-17(16)20-18(22)15-11-7-6-10-14(15)3/h6-13H,4-5H2,1-3H3,(H,20,22).
What are the key properties of N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide?
N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide has a molecular weight of 310.40 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylcarbamoyl)phenyl]-2-methylbenzamide is sourced from PubChem (CID 737730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).