N-(2-amino-4-methylphenyl)-3-ethoxybenzamide

C16H18N2O2 — CID 56773265

IUPACN-(2-amino-4-methylphenyl)-3-ethoxybenzamide
SMILESCCOc1cccc(C(=O)Nc2ccc(C)cc2N)c1
InChIInChI=1S/C16H18N2O2/c1-3-20-13-6-4-5-12(10-13)16(19)18-15-8-7-11(2)9-14(15)17/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeySMHUTXWTQBLBGI-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.23
Rot. Bonds4

About N-(2-amino-4-methylphenyl)-3-ethoxybenzamide

N-(2-amino-4-methylphenyl)-3-ethoxybenzamide (PubChem CID 56773265) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)-3-ethoxybenzamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)-3-ethoxybenzamide
PubChem CID56773265
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(2-amino-4-methylphenyl)-3-ethoxybenzamide
SMILESCCOc1cccc(C(=O)Nc2ccc(C)cc2N)c1
InChIInChI=1S/C16H18N2O2/c1-3-20-13-6-4-5-12(10-13)16(19)18-15-8-7-11(2)9-14(15)17/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeySMHUTXWTQBLBGI-UHFFFAOYSA-N
XLogP3.23
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]phenyl]benzamide
CID 4958088
N-(4-amino-2-chlorophenyl)-3-ethoxybenzamide
CID 100829813
N-[4-[(3-ethoxybenzoyl)amino]phenyl]-3-methylbenzamide
CID 1361715
N-(2-amino-4-ethoxyphenyl)-4-ethoxybenzamide
CID 91687646
3-ethoxy-N-(4-iodo-2-methylphenyl)benzamide
CID 23733721
N-(4-amino-2-methoxyphenyl)-3-ethoxybenzamide
CID 54852547
3-ethoxy-N-(2,4,5-trichlorophenyl)benzamide
CID 790473
3-ethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 799138
N-(5-acetamido-2-methylphenyl)-3-ethoxybenzamide
CID 108788826
N-(2-amino-4-methylphenyl)-3,4-dimethoxybenzamide
CID 28866924
methyl 2-[(3-ethoxybenzoyl)amino]benzoate
CID 881681
N-(2,5-dimethylphenyl)-3-(2-phenoxyethoxy)benzamide
CID 4954927

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)-3-ethoxybenzamide?
The IUPAC name of N-(2-amino-4-methylphenyl)-3-ethoxybenzamide (CID 56773265) is N-(2-amino-4-methylphenyl)-3-ethoxybenzamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)-3-ethoxybenzamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)-3-ethoxybenzamide is CCOc1cccc(C(=O)Nc2ccc(C)cc2N)c1.
What is the InChIKey of N-(2-amino-4-methylphenyl)-3-ethoxybenzamide?
The InChIKey is SMHUTXWTQBLBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-3-20-13-6-4-5-12(10-13)16(19)18-15-8-7-11(2)9-14(15)17/h4-10H,3,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-4-methylphenyl)-3-ethoxybenzamide?
N-(2-amino-4-methylphenyl)-3-ethoxybenzamide has a molecular weight of 270.33 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)-3-ethoxybenzamide is sourced from PubChem (CID 56773265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).