2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide

C13H20N2O2 — CID 43601366

IUPAC2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide
SMILESCCNCc1ccccc1NC(=O)COCC
InChIInChI=1S/C13H20N2O2/c1-3-14-9-11-7-5-6-8-12(11)15-13(16)10-17-4-2/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16)
InChIKeyWJPJQABTGSUFKF-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.77
Rot. Bonds7

About 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide

2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide (PubChem CID 43601366) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide
PubChem CID43601366
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide
SMILESCCNCc1ccccc1NC(=O)COCC
InChIInChI=1S/C13H20N2O2/c1-3-14-9-11-7-5-6-8-12(11)15-13(16)10-17-4-2/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16)
InChIKeyWJPJQABTGSUFKF-UHFFFAOYSA-N
XLogP1.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(2-bromoethylamino)methyl]phenyl]-2-ethoxyacetamide
CID 23621114
N-[2-[(dimethylamino)methyl]phenyl]-2-ethoxyacetamide
CID 60763631
2-(4-ethoxyphenoxy)-N-[2-(ethylaminomethyl)phenyl]acetamide;hydrochloride
CID 119439853
N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
CID 119438958
N-[2-(ethylaminomethyl)phenyl]nonanamide
CID 65425982
N-[2-(ethylaminomethyl)phenyl]-2-methylsulfonylacetamide;hydrochloride
CID 119440105
N-[2-(ethylaminomethyl)phenyl]-4-methyl-3-phenylpentanamide
CID 119438867
2-(2,5-dimethylphenoxy)-N-[2-(ethylaminomethyl)phenyl]acetamide;hydrochloride
CID 119440106
N-[2-(ethylaminomethyl)phenyl]pent-4-enamide
CID 62678727
N-[2-(ethylaminomethyl)phenyl]-4-oxo-4-phenylbutanamide
CID 119440695
2-cyclopentyl-N-[2-(ethylaminomethyl)phenyl]acetamide
CID 60776430
N-[2-(ethylaminomethyl)phenyl]pent-4-ynamide
CID 114028604

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide?
The IUPAC name of 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide (CID 43601366) is 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide is CCNCc1ccccc1NC(=O)COCC.
What is the InChIKey of 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide?
The InChIKey is WJPJQABTGSUFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-3-14-9-11-7-5-6-8-12(11)15-13(16)10-17-4-2/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16).
What are the key properties of 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide?
2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(ethylaminomethyl)phenyl]acetamide is sourced from PubChem (CID 43601366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).