N-(3-carbamoylphenyl)-2-ethoxybenzamide

C16H16N2O3 — CID 25049798

IUPACN-(3-carbamoylphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(C(N)=O)c1
InChIInChI=1S/C16H16N2O3/c1-2-21-14-9-4-3-8-13(14)16(20)18-12-7-5-6-11(10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeyFJXXBQPRAVXJPT-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.44
Rot. Bonds5

About N-(3-carbamoylphenyl)-2-ethoxybenzamide

N-(3-carbamoylphenyl)-2-ethoxybenzamide (PubChem CID 25049798) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is N-(3-carbamoylphenyl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(3-carbamoylphenyl)-2-ethoxybenzamide
PubChem CID25049798
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC NameN-(3-carbamoylphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(C(N)=O)c1
InChIInChI=1S/C16H16N2O3/c1-2-21-14-9-4-3-8-13(14)16(20)18-12-7-5-6-11(10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20)
InChIKeyFJXXBQPRAVXJPT-UHFFFAOYSA-N
XLogP2.44
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoylphenyl)-2-ethoxybenzamide?
The IUPAC name of N-(3-carbamoylphenyl)-2-ethoxybenzamide (CID 25049798) is N-(3-carbamoylphenyl)-2-ethoxybenzamide.
What is the SMILES notation for N-(3-carbamoylphenyl)-2-ethoxybenzamide?
The canonical SMILES for N-(3-carbamoylphenyl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)Nc1cccc(C(N)=O)c1.
What is the InChIKey of N-(3-carbamoylphenyl)-2-ethoxybenzamide?
The InChIKey is FJXXBQPRAVXJPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-2-21-14-9-4-3-8-13(14)16(20)18-12-7-5-6-11(10-12)15(17)19/h3-10H,2H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of N-(3-carbamoylphenyl)-2-ethoxybenzamide?
N-(3-carbamoylphenyl)-2-ethoxybenzamide has a molecular weight of 284.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoylphenyl)-2-ethoxybenzamide is sourced from PubChem (CID 25049798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).