2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide

C13H20N2O2 — CID 63062212

IUPAC2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide
SMILESCC(C)CNCc1ccccc1OCC(N)=O
InChIInChI=1S/C13H20N2O2/c1-10(2)7-15-8-11-5-3-4-6-12(11)17-9-13(14)16/h3-6,10,15H,7-9H2,1-2H3,(H2,14,16)
InChIKeyXTOPCKDCVSAZFD-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.30
Rot. Bonds7

About 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide

2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide (PubChem CID 63062212) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide
PubChem CID63062212
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide
SMILESCC(C)CNCc1ccccc1OCC(N)=O
InChIInChI=1S/C13H20N2O2/c1-10(2)7-15-8-11-5-3-4-6-12(11)17-9-13(14)16/h3-6,10,15H,7-9H2,1-2H3,(H2,14,16)
InChIKeyXTOPCKDCVSAZFD-UHFFFAOYSA-N
XLogP1.30
TPSA64.35 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 ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-fluoro-6-[(2-methylpropylamino)methyl]phenoxy]acetamide
CID 112610813
2-[2-chloro-6-[(2-methylpropylamino)methyl]phenoxy]acetamide
CID 112610532
N-[[2-(2-methoxyethoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 61222098
2-[2-[(2-methylpropylamino)methyl]phenoxy]-N-(2-phenylethyl)acetamide;hydrochloride
CID 2979035
N-carbamoyl-2-[2-[(2-methylpropylamino)methyl]phenoxy]propanamide
CID 63062222
2-[2-[(2-hydroxypropylamino)methyl]phenoxy]-N-methylacetamide
CID 47397786
N,N-dimethyl-4-[2-[(2-methylpropylamino)methyl]phenoxy]butanamide
CID 63057663
N-[[2-(ethoxymethoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 65369676
2-methyl-N-[[2-(2-methylsulfonylethoxy)phenyl]methyl]propan-1-amine
CID 63063942
N-[[2-[3-(2-methoxyethoxy)propoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 103409052
2-[2-[(2,4,4-trimethylpentan-2-ylamino)methyl]phenoxy]acetamide
CID 6459149
2-[(2-ethoxyphenyl)methylamino]-N-(2-methylpropyl)acetamide
CID 112690620

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide?
The IUPAC name of 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide (CID 63062212) is 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide.
What is the SMILES notation for 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide?
The canonical SMILES for 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide is CC(C)CNCc1ccccc1OCC(N)=O.
What is the InChIKey of 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide?
The InChIKey is XTOPCKDCVSAZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)7-15-8-11-5-3-4-6-12(11)17-9-13(14)16/h3-6,10,15H,7-9H2,1-2H3,(H2,14,16).
What are the key properties of 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide?
2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.30, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methylpropylamino)methyl]phenoxy]acetamide is sourced from PubChem (CID 63062212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).