N-(2-ethylphenyl)-3-formamidobenzamide

C16H16N2O2 — CID 168654559

IUPACN-(2-ethylphenyl)-3-formamidobenzamide
SMILESCCc1ccccc1NC(=O)c1cccc(NC=O)c1
InChIInChI=1S/C16H16N2O2/c1-2-12-6-3-4-9-15(12)18-16(20)13-7-5-8-14(10-13)17-11-19/h3-11H,2H2,1H3,(H,17,19)(H,18,20)
InChIKeyDMIAYYZOMKUFML-UHFFFAOYSA-N
MW268.32 g/mol
LogP3.07
Rot. Bonds5

About N-(2-ethylphenyl)-3-formamidobenzamide

N-(2-ethylphenyl)-3-formamidobenzamide (PubChem CID 168654559) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(2-ethylphenyl)-3-formamidobenzamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-3-formamidobenzamide
PubChem CID168654559
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(2-ethylphenyl)-3-formamidobenzamide
SMILESCCc1ccccc1NC(=O)c1cccc(NC=O)c1
InChIInChI=1S/C16H16N2O2/c1-2-12-6-3-4-9-15(12)18-16(20)13-7-5-8-14(10-13)17-11-19/h3-11H,2H2,1H3,(H,17,19)(H,18,20)
InChIKeyDMIAYYZOMKUFML-UHFFFAOYSA-N
XLogP3.07
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-formamido-N-(2-methylphenyl)benzamide
CID 168653763
N-(2-ethylphenyl)-3-(ethylsulfonylamino)benzamide
CID 36859745
1-N-(4-acetylphenyl)-3-N-(2-ethylphenyl)benzene-1,3-dicarboxamide
CID 109057295
3-(dimethylcarbamoylamino)-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 119440210
2-N-(3-acetylphenyl)-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092202
3-N-(2-ethylphenyl)-1-N-(2-methylpropyl)benzene-1,3-dicarboxamide
CID 109051337
N-(2-ethylphenyl)-3-phenylmethoxybenzamide
CID 801132
N-(2-ethylphenyl)-3-(4-formylpiperazine-1-carbonyl)benzamide
CID 109053802
2-[2-[(3-bromobenzoyl)amino]phenyl]acetic acid
CID 62537049
3-N-(2-ethylphenyl)-1-N-[(2-fluorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054619
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090820
N-(2-ethylphenyl)-3-phenacylsulfanylbenzamide
CID 84552506

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-3-formamidobenzamide?
The IUPAC name of N-(2-ethylphenyl)-3-formamidobenzamide (CID 168654559) is N-(2-ethylphenyl)-3-formamidobenzamide.
What is the SMILES notation for N-(2-ethylphenyl)-3-formamidobenzamide?
The canonical SMILES for N-(2-ethylphenyl)-3-formamidobenzamide is CCc1ccccc1NC(=O)c1cccc(NC=O)c1.
What is the InChIKey of N-(2-ethylphenyl)-3-formamidobenzamide?
The InChIKey is DMIAYYZOMKUFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-2-12-6-3-4-9-15(12)18-16(20)13-7-5-8-14(10-13)17-11-19/h3-11H,2H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-ethylphenyl)-3-formamidobenzamide?
N-(2-ethylphenyl)-3-formamidobenzamide has a molecular weight of 268.32 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-3-formamidobenzamide is sourced from PubChem (CID 168654559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).