2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide

C13H20N2O2 — CID 43507750

IUPAC2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide
SMILESCCOCC(=O)Nc1cccc(C(C)NC)c1
InChIInChI=1S/C13H20N2O2/c1-4-17-9-13(16)15-12-7-5-6-11(8-12)10(2)14-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyAIIUHFKKJAGKGW-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.94
Rot. Bonds6

About 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide

2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide (PubChem CID 43507750) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide
PubChem CID43507750
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide
SMILESCCOCC(=O)Nc1cccc(C(C)NC)c1
InChIInChI=1S/C13H20N2O2/c1-4-17-9-13(16)15-12-7-5-6-11(8-12)10(2)14-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyAIIUHFKKJAGKGW-UHFFFAOYSA-N
XLogP1.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[1-(methylamino)ethyl]phenyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602422
N-[3-[1-(methylamino)ethyl]phenyl]acetamide
CID 43200396
1-(2-ethoxyethyl)-1-methyl-3-[3-[1-(methylamino)ethyl]phenyl]urea
CID 81062754
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]butanamide
CID 43507778
2-ethoxy-N-(3-hydroxyphenyl)acetamide
CID 28780663
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]propanamide
CID 43507738
2-ethoxy-N-[3-[(propan-2-ylamino)methyl]phenyl]acetamide
CID 106910809
N-[3-(bromomethyl)phenyl]-2-ethoxyacetamide
CID 114307296
2-ethoxy-N-(3-ethoxyphenyl)acetamide
CID 61062065
1-butan-2-yl-3-[3-[1-(methylamino)ethyl]phenyl]urea
CID 61341261
2-ethoxy-N-[3-(methylaminomethyl)phenyl]acetamide;hydrochloride
CID 119441041
2-methyl-N-[3-[1-(methylamino)ethyl]phenyl]pentanamide
CID 43507752

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide?
The IUPAC name of 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide (CID 43507750) is 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide is CCOCC(=O)Nc1cccc(C(C)NC)c1.
What is the InChIKey of 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide?
The InChIKey is AIIUHFKKJAGKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-17-9-13(16)15-12-7-5-6-11(8-12)10(2)14-3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16).
What are the key properties of 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide?
2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.94, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[3-[1-(methylamino)ethyl]phenyl]acetamide is sourced from PubChem (CID 43507750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).