3-amino-2-ethoxy-N-methylbenzamide

C10H14N2O2 — CID 112693169

IUPAC3-amino-2-ethoxy-N-methylbenzamide
SMILESCCOc1c(N)cccc1C(=O)NC
InChIInChI=1S/C10H14N2O2/c1-3-14-9-7(10(13)12-2)5-4-6-8(9)11/h4-6H,3,11H2,1-2H3,(H,12,13)
InChIKeySFJDLKOOGVDRFY-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.03
Rot. Bonds3

About 3-amino-2-ethoxy-N-methylbenzamide

3-amino-2-ethoxy-N-methylbenzamide (PubChem CID 112693169) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-amino-2-ethoxy-N-methylbenzamide.

Molecular Properties

Compound Name3-amino-2-ethoxy-N-methylbenzamide
PubChem CID112693169
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-amino-2-ethoxy-N-methylbenzamide
SMILESCCOc1c(N)cccc1C(=O)NC
InChIInChI=1S/C10H14N2O2/c1-3-14-9-7(10(13)12-2)5-4-6-8(9)11/h4-6H,3,11H2,1-2H3,(H,12,13)
InChIKeySFJDLKOOGVDRFY-UHFFFAOYSA-N
XLogP1.03
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.03
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

3-amino-N-methyl-2-(2-methylpropoxy)benzamide
CID 154814953
3-amino-2-ethoxy-N-(2-hydroxypropyl)benzamide
CID 113386382
3-amino-N-(2,2-dimethylbutyl)-2-ethoxybenzamide
CID 103459929
3-amino-2-ethoxy-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 113472635
3-amino-2-ethoxy-N-(5-hydroxypentyl)benzamide
CID 107316231
3-amino-N-methyl-2-propan-2-yloxybenzamide
CID 154814948
3-amino-N-(2,2-difluoro-3-hydroxypropyl)-2-ethoxybenzamide
CID 106164172
3-amino-2-ethoxy-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]benzamide
CID 106379162
3-amino-2-ethoxy-N-pent-4-yn-2-ylbenzamide
CID 113476869
3-amino-2-ethoxy-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
CID 104616592
3-amino-2-ethoxy-N-(1-hydroxy-4,4-dimethylpentan-3-yl)benzamide
CID 106347855
3-amino-2-ethoxy-N-(4-hydroxy-1-methoxybutan-2-yl)benzamide
CID 106151929

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-ethoxy-N-methylbenzamide?
The IUPAC name of 3-amino-2-ethoxy-N-methylbenzamide (CID 112693169) is 3-amino-2-ethoxy-N-methylbenzamide.
What is the SMILES notation for 3-amino-2-ethoxy-N-methylbenzamide?
The canonical SMILES for 3-amino-2-ethoxy-N-methylbenzamide is CCOc1c(N)cccc1C(=O)NC.
What is the InChIKey of 3-amino-2-ethoxy-N-methylbenzamide?
The InChIKey is SFJDLKOOGVDRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-3-14-9-7(10(13)12-2)5-4-6-8(9)11/h4-6H,3,11H2,1-2H3,(H,12,13).
What are the key properties of 3-amino-2-ethoxy-N-methylbenzamide?
3-amino-2-ethoxy-N-methylbenzamide has a molecular weight of 194.23 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-ethoxy-N-methylbenzamide is sourced from PubChem (CID 112693169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).