N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide

C12H18N2O2 — CID 43279883

IUPACN-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide
SMILESCNC(=O)COc1cccc(C(C)NC)c1
InChIInChI=1S/C12H18N2O2/c1-9(13-2)10-5-4-6-11(7-10)16-8-12(15)14-3/h4-7,9,13H,8H2,1-3H3,(H,14,15)
InChIKeyHPGLVZOWQGFOHT-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.09
Rot. Bonds5

About N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide

N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide (PubChem CID 43279883) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide.

Molecular Properties

Compound NameN-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide
PubChem CID43279883
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide
SMILESCNC(=O)COc1cccc(C(C)NC)c1
InChIInChI=1S/C12H18N2O2/c1-9(13-2)10-5-4-6-11(7-10)16-8-12(15)14-3/h4-7,9,13H,8H2,1-3H3,(H,14,15)
InChIKeyHPGLVZOWQGFOHT-UHFFFAOYSA-N
XLogP1.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide
CID 43279890
1-[3-[(E)-3-chloro-2-methylprop-2-enoxy]phenyl]-N-methylethanamine
CID 106436816
N-methyl-2-(3-methylphenoxy)acetamide
CID 15943355
2-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-N-methylacetamide
CID 107716600
N-methyl-1-(3-propoxyphenyl)ethanamine
CID 43279892
N-methyl-2-[3-(1-pyridin-4-ylethylamino)phenoxy]acetamide
CID 43693413
N-methyl-1-[3-(3-phenoxypropoxy)phenyl]ethanamine
CID 62936434
1-[3-[1-(methylamino)ethyl]phenoxy]butan-2-ol
CID 60883271
(2S)-N-[(1S)-1-(3-ethoxyphenyl)ethyl]-2-(methylamino)propanamide
CID 125458965
1-[[3-[1-(methylamino)ethyl]phenoxy]methyl]cyclohexan-1-ol
CID 65208480
N-methyl-2-[3-(2-methylbutyl)phenoxy]acetamide
CID 138724732
2-[3-[1-(ethylamino)ethyl]phenoxy]-N-(3-methylbutan-2-yl)acetamide
CID 61489519

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide?
The IUPAC name of N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide (CID 43279883) is N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide.
What is the SMILES notation for N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide?
The canonical SMILES for N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide is CNC(=O)COc1cccc(C(C)NC)c1.
What is the InChIKey of N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide?
The InChIKey is HPGLVZOWQGFOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9(13-2)10-5-4-6-11(7-10)16-8-12(15)14-3/h4-7,9,13H,8H2,1-3H3,(H,14,15).
What are the key properties of N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide?
N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide is sourced from PubChem (CID 43279883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).