2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide

C16H18N2O3 — CID 81394304

IUPAC2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide
SMILESCCOc1cccc(NC(=O)c2c(N)cccc2OC)c1
InChIInChI=1S/C16H18N2O3/c1-3-21-12-7-4-6-11(10-12)18-16(19)15-13(17)8-5-9-14(15)20-2/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeySHOADUUMGAVHNH-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.93
Rot. Bonds5

About 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide

2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide (PubChem CID 81394304) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide
PubChem CID81394304
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide
SMILESCCOc1cccc(NC(=O)c2c(N)cccc2OC)c1
InChIInChI=1S/C16H18N2O3/c1-3-21-12-7-4-6-11(10-12)18-16(19)15-13(17)8-5-9-14(15)20-2/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeySHOADUUMGAVHNH-UHFFFAOYSA-N
XLogP2.93
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(3,4-dimethylphenyl)-6-ethoxybenzamide
CID 81394623
2-amino-6-methoxy-N-pyridin-4-ylbenzamide
CID 81410012
2-amino-6-ethoxy-N-(4-fluoro-3-methylphenyl)benzamide
CID 81394860
3-amino-4-chloro-N-(3-ethoxyphenyl)benzamide
CID 60926921
3-amino-5-ethoxy-N-(3-methoxyphenyl)benzamide
CID 81094945
2-amino-N-(1,3-benzothiazol-6-yl)-6-methoxybenzamide
CID 107802446
2-[(3-ethoxyphenyl)carbamoyl]benzoic acid
CID 17098079
2-amino-N-(3-ethoxyphenyl)-3-methylbenzamide
CID 61103168
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-(3-ethoxyphenyl)-2-hydrazinylbenzamide
CID 62247314
4-carbamothioyl-N-(3-ethoxyphenyl)benzamide
CID 61242679
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide?
The IUPAC name of 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide (CID 81394304) is 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide.
What is the SMILES notation for 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide?
The canonical SMILES for 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide is CCOc1cccc(NC(=O)c2c(N)cccc2OC)c1.
What is the InChIKey of 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide?
The InChIKey is SHOADUUMGAVHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-21-12-7-4-6-11(10-12)18-16(19)15-13(17)8-5-9-14(15)20-2/h4-10H,3,17H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide?
2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide has a molecular weight of 286.33 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide is sourced from PubChem (CID 81394304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).