N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide

C16H18N2O3 — CID 63257836

IUPACN-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(OC)ccc1N
InChIInChI=1S/C16H18N2O3/c1-3-21-15-7-5-4-6-12(15)16(19)18-14-10-11(20-2)8-9-13(14)17/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyCKHMLNGGGMRGTM-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.93
Rot. Bonds5

About N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide

N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide (PubChem CID 63257836) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide
PubChem CID63257836
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(OC)ccc1N
InChIInChI=1S/C16H18N2O3/c1-3-21-15-7-5-4-6-12(15)16(19)18-14-10-11(20-2)8-9-13(14)17/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyCKHMLNGGGMRGTM-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

N-(2,5-diethoxyphenyl)-2-ethoxybenzamide
CID 43000684
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
N-(4-amino-3-methoxyphenyl)-2-ethoxybenzamide
CID 61239481
N-(4-amino-2,5-diethoxyphenyl)-2-methoxybenzamide
CID 23464291
N-(2,5-dimethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355355
N-(2-amino-5-methoxyphenyl)-4-butoxy-3-ethoxybenzamide
CID 119421219
N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide
CID 30804314
2-amino-N-(2-ethoxyphenyl)-5-hydroxybenzamide
CID 107073822
N-(3-amino-4-ethoxyphenyl)-2-methoxybenzamide
CID 70635969
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
2,4-diethoxy-N-(2-ethoxyphenyl)benzamide
CID 17340647

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide?
The IUPAC name of N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide (CID 63257836) is N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide.
What is the SMILES notation for N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide?
The canonical SMILES for N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)Nc1cc(OC)ccc1N.
What is the InChIKey of N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide?
The InChIKey is CKHMLNGGGMRGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-21-15-7-5-4-6-12(15)16(19)18-14-10-11(20-2)8-9-13(14)17/h4-10H,3,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide?
N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide 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 N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide is sourced from PubChem (CID 63257836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).