3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide

C11H16N2O3 — CID 61093968

IUPAC3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide
SMILESCCOc1ccc(C(=O)NCCO)cc1N
InChIInChI=1S/C11H16N2O3/c1-2-16-10-4-3-8(7-9(10)12)11(15)13-5-6-14/h3-4,7,14H,2,5-6,12H2,1H3,(H,13,15)
InChIKeyUOKFXWMQSYSDDW-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.39
Rot. Bonds5

About 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide

3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide (PubChem CID 61093968) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide
PubChem CID61093968
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide
SMILESCCOc1ccc(C(=O)NCCO)cc1N
InChIInChI=1S/C11H16N2O3/c1-2-16-10-4-3-8(7-9(10)12)11(15)13-5-6-14/h3-4,7,14H,2,5-6,12H2,1H3,(H,13,15)
InChIKeyUOKFXWMQSYSDDW-UHFFFAOYSA-N
XLogP0.39
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-ethoxy-N-hexylbenzamide
CID 61112297
3-amino-4-ethoxy-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 82070377
3-amino-4-ethoxy-N-(2-hydroxy-2-methylbutyl)benzamide
CID 65103916
3-amino-N-[(4-chlorophenyl)methyl]-4-ethoxybenzamide
CID 61095701
3-amino-N-[(4-bromophenyl)methyl]-4-ethoxybenzamide
CID 61090989
3-amino-N-[2-(cyclohexen-1-yl)ethyl]-4-ethoxybenzamide
CID 61118160
3-amino-4-ethoxy-N-[2-(1-methylpyrazol-3-yl)ethyl]benzamide
CID 106103818
3,4-diethoxy-N-(5-hydroxypentyl)benzamide
CID 107319057
3-amino-N-cyclohexyl-4-ethoxybenzamide
CID 28689929
3-amino-4-ethoxy-N-(1-hydroxybutan-2-yl)benzamide
CID 61094806
3-amino-4-ethoxy-N-[2-(1-methylpyrazol-4-yl)ethyl]benzamide
CID 78984283
3-amino-4-(2-methylprop-2-enoxy)-N-propylbenzamide
CID 82070436

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide (CID 61093968) is 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide is CCOc1ccc(C(=O)NCCO)cc1N.
What is the InChIKey of 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide?
The InChIKey is UOKFXWMQSYSDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-2-16-10-4-3-8(7-9(10)12)11(15)13-5-6-14/h3-4,7,14H,2,5-6,12H2,1H3,(H,13,15).
What are the key properties of 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide?
3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide has a molecular weight of 224.26 g/mol, XLogP of 0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-ethoxy-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 61093968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).