N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide

C16H18N2O2 — CID 43599944

IUPACN-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(OC)c(N)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-3-11-4-6-12(7-5-11)16(19)18-13-8-9-15(20-2)14(17)10-13/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyJCGHPFPSYKMALR-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.09
Rot. Bonds4

About N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide

N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide (PubChem CID 43599944) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide.

Molecular Properties

Compound NameN-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
PubChem CID43599944
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
SMILESCCc1ccc(C(=O)Nc2ccc(OC)c(N)c2)cc1
InChIInChI=1S/C16H18N2O2/c1-3-11-4-6-12(7-5-11)16(19)18-13-8-9-15(20-2)14(17)10-13/h4-10H,3,17H2,1-2H3,(H,18,19)
InChIKeyJCGHPFPSYKMALR-UHFFFAOYSA-N
XLogP3.09
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 ≤ 53.09
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

N-(3-amino-4-methoxyphenyl)-4-hydroxybenzamide
CID 43599919
N-(3-chloro-4-methoxyphenyl)-4-ethylbenzamide
CID 2540642
N-(3-amino-4-methoxyphenyl)-4-(4-ethylphenyl)-4-oxobutanamide
CID 119419435
N-(3-amino-4-methoxyphenyl)-4-tert-butylbenzamide
CID 18524942
N-(3-amino-4-methoxyphenyl)-3,5-dibromobenzamide
CID 107971090
N-(3-amino-4-methoxyphenyl)benzamide;molecular nitrogen
CID 174994775
N-(3-amino-4-methoxyphenyl)-3,4-dipropoxybenzamide
CID 119420223
N-(3-amino-4-methoxyphenyl)-4-hexadecoxybenzamide
CID 70436318
N-(3-amino-4-ethoxyphenyl)-4-methoxybenzamide
CID 23464410
N-(3-amino-4-methoxyphenyl)-4-[ethyl(propyl)amino]benzamide;dihydrochloride
CID 119419016
N-(3-amino-4-methoxyphenyl)-4-(butan-2-ylsulfamoyl)benzamide
CID 119420171
N-(3-amino-4-methoxyphenyl)-3-fluorobenzamide
CID 28866814

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide?
The IUPAC name of N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide (CID 43599944) is N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide.
What is the SMILES notation for N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide?
The canonical SMILES for N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide is CCc1ccc(C(=O)Nc2ccc(OC)c(N)c2)cc1.
What is the InChIKey of N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide?
The InChIKey is JCGHPFPSYKMALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-3-11-4-6-12(7-5-11)16(19)18-13-8-9-15(20-2)14(17)10-13/h4-10H,3,17H2,1-2H3,(H,18,19).
What are the key properties of N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide?
N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide has a molecular weight of 270.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide is sourced from PubChem (CID 43599944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).