4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide

C16H18N2O2 — CID 91665664

IUPAC4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(-c2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-20-11-10-18-16(19)14-4-2-12(3-5-14)13-6-8-15(17)9-7-13/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyDYDYZPQAUSYBOG-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.31
Rot. Bonds5

About 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide

4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide (PubChem CID 91665664) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide
PubChem CID91665664
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(-c2ccc(N)cc2)cc1
InChIInChI=1S/C16H18N2O2/c1-20-11-10-18-16(19)14-4-2-12(3-5-14)13-6-8-15(17)9-7-13/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyDYDYZPQAUSYBOG-UHFFFAOYSA-N
XLogP2.31
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N-(2-methoxyethyl)benzamide
CID 3457742
4-amino-N-(2-butoxyethyl)benzamide
CID 61171616
2-[(4-aminobenzoyl)amino]ethyl 2-methylprop-2-enoate
CID 118056637
N-(2-methoxyethyl)-4-[6-[4-(2-methoxyethylcarbamoyl)phenyl]pyrimidin-4-yl]benzamide
CID 11080574
4-N-tert-butyl-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 47437380
4-(furan-2-yl)-N-(2-methoxyethyl)benzamide
CID 168525529
N-(2-methoxyethyl)-4-(3-methylpentan-3-yl)benzamide
CID 70934716
3-amino-4-methoxy-N-(2-methoxyethyl)benzamide
CID 16772972
tert-butyl N-[2-[2-[2-[(4-aminobenzoyl)amino]ethoxy]ethoxy]ethyl]carbamate
CID 102393692
4-amino-N-(2-hydroxyethyl)benzamide;ethane;molecular hydrogen
CID 156799285
N-(2-aminooxyethyl)-4-methylbenzamide
CID 39239063
4-(4-aminophenyl)-N-methylbenzamide
CID 91665695

Frequently Asked Questions

What is the IUPAC name of 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide (CID 91665664) is 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1ccc(-c2ccc(N)cc2)cc1.
What is the InChIKey of 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide?
The InChIKey is DYDYZPQAUSYBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-20-11-10-18-16(19)14-4-2-12(3-5-14)13-6-8-15(17)9-7-13/h2-9H,10-11,17H2,1H3,(H,18,19).
What are the key properties of 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide?
4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 91665664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).