N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide

C16H18N2O3 — CID 23464410

IUPACN-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide
SMILESCCOc1ccc(NC(=O)c2ccc(OC)cc2)cc1N
InChIInChI=1S/C16H18N2O3/c1-3-21-15-9-6-12(10-14(15)17)18-16(19)11-4-7-13(20-2)8-5-11/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyBXHLAORUIFPNCX-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.93
Rot. Bonds5

About N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide

N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide (PubChem CID 23464410) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide
PubChem CID23464410
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide
SMILESCCOc1ccc(NC(=O)c2ccc(OC)cc2)cc1N
InChIInChI=1S/C16H18N2O3/c1-3-21-15-9-6-12(10-14(15)17)18-16(19)11-4-7-13(20-2)8-5-11/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyBXHLAORUIFPNCX-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

1-N,4-N-bis(4-ethoxy-3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 24645019
N-(3-amino-4-methoxyphenyl)-4-hexadecoxybenzamide
CID 70436318
N-(3-amino-4-ethoxyphenyl)acetamide
CID 28207
N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
CID 43599944
4-butoxy-3-ethoxy-N-(4-methoxyphenyl)benzamide
CID 27228846
N-(3-amino-4-ethoxyphenyl)-2-methoxybenzamide
CID 70635969
N-(3-amino-4-chlorophenyl)-4-ethoxybenzamide
CID 18071163
4-amino-3-methoxy-N-(4-methoxyphenyl)benzamide
CID 89028367
N-(3-amino-4-methoxyphenyl)-4-hydroxybenzamide
CID 43599919
3-[(4-ethoxybenzoyl)amino]-N-(4-methoxyphenyl)benzamide
CID 1228510
N-(2-ethoxyphenyl)-4-[(4-methoxybenzoyl)amino]benzamide
CID 2222263
N-(3-amino-4-methoxyphenyl)-3,4-dipropoxybenzamide
CID 119420223

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide?
The IUPAC name of N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide (CID 23464410) is N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide?
The canonical SMILES for N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide is CCOc1ccc(NC(=O)c2ccc(OC)cc2)cc1N.
What is the InChIKey of N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide?
The InChIKey is BXHLAORUIFPNCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-21-15-9-6-12(10-14(15)17)18-16(19)11-4-7-13(20-2)8-5-11/h4-10H,3,17H2,1-2H3,(H,18,19).
What are the key properties of N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide?
N-(3-amino-4-ethoxyphenyl)-4-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 N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 23464410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).