N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide

C12H18N2O2 — CID 119501823

IUPACN-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide
SMILESCNCCNC(=O)COCc1ccccc1
InChIInChI=1S/C12H18N2O2/c1-13-7-8-14-12(15)10-16-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15)
InChIKeyDGBXOKANJDHIHS-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.54
Rot. Bonds7

About N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide

N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide (PubChem CID 119501823) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide
PubChem CID119501823
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide
SMILESCNCCNC(=O)COCc1ccccc1
InChIInChI=1S/C12H18N2O2/c1-13-7-8-14-12(15)10-16-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15)
InChIKeyDGBXOKANJDHIHS-UHFFFAOYSA-N
XLogP0.54
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-2-phenylmethoxyacetamide
CID 126717674
N-(3,3-dimethylbutyl)-2-phenylmethoxyacetamide
CID 58756722
4-[(2-phenylmethoxyacetyl)amino]butanoic acid
CID 43239307
(2S)-2-hydroxy-4-[(2-phenylmethoxyacetyl)amino]butanoic acid
CID 107834653
benzyl N-[2-(methylamino)ethyl]carbamate
CID 10822258
N-(3,3-difluoro-2-hydroxypropyl)-2-phenylmethoxyacetamide
CID 103770216
1-(methylamino)-3-phenylmethoxypropan-2-one
CID 143048834
2-hydroxy-2-methyl-3-[(2-phenylmethoxyacetyl)amino]propanoic acid
CID 66174585
methyl 2-hydroxy-3-[(2-phenylmethoxyacetyl)amino]propanoate
CID 103957951
2-methoxy-3-[(2-phenylmethoxyacetyl)amino]propanoic acid
CID 106107823
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
N-(2,3-dihydroxypropyl)-2-phenylmethoxyacetamide
CID 66177316

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide?
The IUPAC name of N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide (CID 119501823) is N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide is CNCCNC(=O)COCc1ccccc1.
What is the InChIKey of N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide?
The InChIKey is DGBXOKANJDHIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-13-7-8-14-12(15)10-16-9-11-5-3-2-4-6-11/h2-6,13H,7-10H2,1H3,(H,14,15).
What are the key properties of N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide?
N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide has a molecular weight of 222.29 g/mol, XLogP of 0.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)ethyl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 119501823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).