3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide

C14H22N2O3 — CID 63697687

IUPAC3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide
SMILESCCOCCN(CC)C(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C14H22N2O3/c1-4-16(8-9-19-5-2)14(17)11-6-7-13(18-3)12(15)10-11/h6-7,10H,4-5,8-9,15H2,1-3H3
InChIKeyOPULNQAOAWFZIK-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.78
Rot. Bonds7

About 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide

3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide (PubChem CID 63697687) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide.

Molecular Properties

Compound Name3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide
PubChem CID63697687
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide
SMILESCCOCCN(CC)C(=O)c1ccc(OC)c(N)c1
InChIInChI=1S/C14H22N2O3/c1-4-16(8-9-19-5-2)14(17)11-6-7-13(18-3)12(15)10-11/h6-7,10H,4-5,8-9,15H2,1-3H3
InChIKeyOPULNQAOAWFZIK-UHFFFAOYSA-N
XLogP1.78
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-amino-N-(2-ethoxyethyl)-N-ethyl-3-methoxybenzamide
CID 104782930
3-amino-N,N-diethyl-4-methoxybenzamide
CID 16770695
3-amino-4-ethoxy-N-ethyl-N-propylbenzamide
CID 61094577
3-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
CID 61105605
3-amino-N-[2-(diethylamino)-2-oxoethyl]-4-methoxybenzamide
CID 115597740
N-ethyl-4-methoxy-N-(2-methoxyethyl)-3-sulfamoylbenzamide
CID 65386486
3-amino-N-ethyl-4-methoxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 61115212
3-amino-N-[3-(diethylamino)-3-oxopropyl]-4-methoxybenzamide
CID 61102199
N-(2-ethoxyethyl)-N-ethyl-4-fluoro-3-methylbenzamide
CID 63692679
3-amino-4-bromo-N-ethyl-N-(2-methoxyethyl)benzamide
CID 61443550
6-amino-N-(2-ethoxyethyl)-N-ethylpyridine-3-carboxamide
CID 63690796
3-chloro-N-(2-ethoxyethyl)-N-ethyl-4-hydroxybenzamide
CID 63692359

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide?
The IUPAC name of 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide (CID 63697687) is 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide.
What is the SMILES notation for 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide?
The canonical SMILES for 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide is CCOCCN(CC)C(=O)c1ccc(OC)c(N)c1.
What is the InChIKey of 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide?
The InChIKey is OPULNQAOAWFZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-16(8-9-19-5-2)14(17)11-6-7-13(18-3)12(15)10-11/h6-7,10H,4-5,8-9,15H2,1-3H3.
What are the key properties of 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide?
3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide has a molecular weight of 266.34 g/mol, XLogP of 1.78, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethoxyethyl)-N-ethyl-4-methoxybenzamide is sourced from PubChem (CID 63697687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).