2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide

C10H14N2O — CID 22841823

IUPAC2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide
SMILES[2H]C([2H])(Cc1ccccc1)NCC(N)=O
InChIInChI=1S/C10H14N2O/c11-10(13)8-12-7-6-9-4-2-1-3-5-9/h1-5,12H,6-8H2,(H2,11,13)/i7D2
InChIKeySRFNZJUMTYLFEO-RJSZUWSASA-N
MW180.25 g/mol
LogP0.30
Rot. Bonds5

About 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide

2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide (PubChem CID 22841823) has the molecular formula C10H14N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide.

Molecular Properties

Compound Name2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide
PubChem CID22841823
Molecular FormulaC10H14N2O
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide
SMILES[2H]C([2H])(Cc1ccccc1)NCC(N)=O
InChIInChI=1S/C10H14N2O/c11-10(13)8-12-7-6-9-4-2-1-3-5-9/h1-5,12H,6-8H2,(H2,11,13)/i7D2
InChIKeySRFNZJUMTYLFEO-RJSZUWSASA-N
XLogP0.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(1,1-dideuterio-2-phenylethyl)amino]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-[[(1S)-1-deuterio-3-phenylpropyl]amino]acetamide
CID 57056955
carbonic acid;3-phenylpropanamide
CID 174965682
2-amino-N-(2-amino-2-oxoethyl)-4-phenylbutanamide
CID 114924624
carbanide;3-phenylpropanamide;yttrium
CID 160557542
N-(2-amino-2-oxoethyl)-N'-(4-phenylbutan-2-yl)butanediamide
CID 51362452
benzyl N-(2-amino-2-oxoethyl)carbamate
CID 69459510
iodomethyl carbamate;2-phenylethylbenzene
CID 67308047
3-methyl-3-(methylamino)-5-phenylpentanamide
CID 65236751
2-(benzylcarbamothioylamino)acetamide
CID 123762736
acetamide;propylbenzene
CID 142238516
4-(2-phenylethyl)benzamide
CID 23130460
1,1-dideuterio-2-phenyl(113C)ethanol
CID 10419181

Frequently Asked Questions

What is the IUPAC name of 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide?
The IUPAC name of 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide (CID 22841823) is 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide.
What is the SMILES notation for 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide?
The canonical SMILES for 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide is [2H]C([2H])(Cc1ccccc1)NCC(N)=O.
What is the InChIKey of 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide?
The InChIKey is SRFNZJUMTYLFEO-RJSZUWSASA-N. The full InChI is InChI=1S/C10H14N2O/c11-10(13)8-12-7-6-9-4-2-1-3-5-9/h1-5,12H,6-8H2,(H2,11,13)/i7D2.
What are the key properties of 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide?
2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide has a molecular weight of 180.25 g/mol, XLogP of 0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,1-dideuterio-2-phenylethyl)amino]acetamide is sourced from PubChem (CID 22841823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).