2-[methyl(2-phenylmethoxyethyl)amino]propanamide

C13H20N2O2 — CID 130767373

IUPAC2-[methyl(2-phenylmethoxyethyl)amino]propanamide
SMILESCC(C(N)=O)N(C)CCOCc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-11(13(14)16)15(2)8-9-17-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H2,14,16)
InChIKeyIJCGQHLYRPPKAG-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.01
Rot. Bonds7

About 2-[methyl(2-phenylmethoxyethyl)amino]propanamide

2-[methyl(2-phenylmethoxyethyl)amino]propanamide (PubChem CID 130767373) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-[methyl(2-phenylmethoxyethyl)amino]propanamide.

Molecular Properties

Compound Name2-[methyl(2-phenylmethoxyethyl)amino]propanamide
PubChem CID130767373
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-[methyl(2-phenylmethoxyethyl)amino]propanamide
SMILESCC(C(N)=O)N(C)CCOCc1ccccc1
InChIInChI=1S/C13H20N2O2/c1-11(13(14)16)15(2)8-9-17-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H2,14,16)
InChIKeyIJCGQHLYRPPKAG-UHFFFAOYSA-N
XLogP1.01
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[methyl(2-phenylethyl)amino]propanamide
CID 47280413
[4,4-dimethyl-3-[methyl(2-phenylmethoxyethyl)amino]pentyl] carbamate
CID 177255639
3-N-methyl-3-N-(2-phenylmethoxyethyl)butane-1,3-diamine
CID 130536772
3-amino-N-methyl-N-(2-phenylmethoxyethyl)butanamide;hydrochloride
CID 119821461
2-amino-N-methyl-2-phenyl-N-(2-phenylmethoxyethyl)acetamide
CID 119345164
phenylmethoxy(2-phenylmethoxyethyl)carbamic acid
CID 142651909
tert-butyl N-[3-amino-2-[methyl(2-phenylmethoxyethyl)amino]propyl]carbamate
CID 131008134
2-methoxy-N-methyl-N-(2-phenylmethoxyethyl)acetamide
CID 130767377
2-[2-phenylmethoxyethyl(propan-2-yl)amino]ethanol
CID 130537128
2-[bis(phenylmethoxycarbonyl)amino]propanoic acid
CID 18466015
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-phenylmethoxyethyl)acetamide;hydrochloride
CID 120669222
ethyl 2-[methyl(phenylmethoxycarbonyl)amino]propanoate
CID 59729658

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2-phenylmethoxyethyl)amino]propanamide?
The IUPAC name of 2-[methyl(2-phenylmethoxyethyl)amino]propanamide (CID 130767373) is 2-[methyl(2-phenylmethoxyethyl)amino]propanamide.
What is the SMILES notation for 2-[methyl(2-phenylmethoxyethyl)amino]propanamide?
The canonical SMILES for 2-[methyl(2-phenylmethoxyethyl)amino]propanamide is CC(C(N)=O)N(C)CCOCc1ccccc1.
What is the InChIKey of 2-[methyl(2-phenylmethoxyethyl)amino]propanamide?
The InChIKey is IJCGQHLYRPPKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-11(13(14)16)15(2)8-9-17-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H2,14,16).
What are the key properties of 2-[methyl(2-phenylmethoxyethyl)amino]propanamide?
2-[methyl(2-phenylmethoxyethyl)amino]propanamide has a molecular weight of 236.31 g/mol, XLogP of 1.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2-phenylmethoxyethyl)amino]propanamide is sourced from PubChem (CID 130767373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).