N-(2,6-diethylphenyl)benzamide

C17H19NO — CID 731496

IUPACN-(2,6-diethylphenyl)benzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccccc1
InChIInChI=1S/C17H19NO/c1-3-13-11-8-12-14(4-2)16(13)18-17(19)15-9-6-5-7-10-15/h5-12H,3-4H2,1-2H3,(H,18,19)
InChIKeyOXQRSNLENDFJRJ-UHFFFAOYSA-N
MW253.34 g/mol
LogP4.06
Rot. Bonds4

About N-(2,6-diethylphenyl)benzamide

N-(2,6-diethylphenyl)benzamide (PubChem CID 731496) has the molecular formula C17H19NO and a molecular weight of 253.34 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)benzamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)benzamide
PubChem CID731496
Molecular FormulaC17H19NO
Molecular Weight253.34 g/mol
Exact Mass253.15
IUPAC NameN-(2,6-diethylphenyl)benzamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccccc1
InChIInChI=1S/C17H19NO/c1-3-13-11-8-12-14(4-2)16(13)18-17(19)15-9-6-5-7-10-15/h5-12H,3-4H2,1-2H3,(H,18,19)
InChIKeyOXQRSNLENDFJRJ-UHFFFAOYSA-N
XLogP4.06
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)benzamide?
The IUPAC name of N-(2,6-diethylphenyl)benzamide (CID 731496) is N-(2,6-diethylphenyl)benzamide.
What is the SMILES notation for N-(2,6-diethylphenyl)benzamide?
The canonical SMILES for N-(2,6-diethylphenyl)benzamide is CCc1cccc(CC)c1NC(=O)c1ccccc1.
What is the InChIKey of N-(2,6-diethylphenyl)benzamide?
The InChIKey is OXQRSNLENDFJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-3-13-11-8-12-14(4-2)16(13)18-17(19)15-9-6-5-7-10-15/h5-12H,3-4H2,1-2H3,(H,18,19).
What are the key properties of N-(2,6-diethylphenyl)benzamide?
N-(2,6-diethylphenyl)benzamide has a molecular weight of 253.34 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)benzamide is sourced from PubChem (CID 731496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).