2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone

C13H26N2O2 — CID 119788483

IUPAC2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone
SMILESCOCCNCC(=O)N1CCCCC1C(C)C
InChIInChI=1S/C13H26N2O2/c1-11(2)12-6-4-5-8-15(12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3
InChIKeyHYKUTOAWRWIXCY-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.26
Rot. Bonds6

About 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone

2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone (PubChem CID 119788483) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone
PubChem CID119788483
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone
SMILESCOCCNCC(=O)N1CCCCC1C(C)C
InChIInChI=1S/C13H26N2O2/c1-11(2)12-6-4-5-8-15(12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3
InChIKeyHYKUTOAWRWIXCY-UHFFFAOYSA-N
XLogP1.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone 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-methoxyethylamino)-1-(2-propan-2-ylpyrrolidin-1-yl)ethanone
CID 79290556
(2S)-1-[2-(2-methoxyethylamino)acetyl]pyrrolidine-2-carboxylic acid
CID 79281055
[1-[2-(2-methoxyethylamino)acetyl]piperidin-2-yl]methylurea
CID 119765951
1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
CID 79282787
2-(2-methoxyethylamino)-1-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]ethanone
CID 119851436
1-[2-(1-aminoethyl)piperidin-1-yl]-2-(cyclopropylmethylamino)ethanone
CID 122080228
1-[2-(2-methoxyethylamino)acetyl]piperidine-4-carboxylic acid
CID 79280780
ethane;1-(2-propan-2-ylpiperidin-1-yl)propan-1-one
CID 142558252
1-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-2-(2-methoxyethylamino)ethanone
CID 78914134
1-[(2S,3S)-2-(aminomethyl)-3-methylpiperidin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 124685569
methyl 4-oxo-4-(2-propan-2-ylpyrrolidin-1-yl)butanoate
CID 76708874
3-cyclohexyl-1-[(2R)-2-propan-2-ylpiperidin-1-yl]propan-1-one
CID 99808840

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone (CID 119788483) is 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone is COCCNCC(=O)N1CCCCC1C(C)C.
What is the InChIKey of 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone?
The InChIKey is HYKUTOAWRWIXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-11(2)12-6-4-5-8-15(12)13(16)10-14-7-9-17-3/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone?
2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone has a molecular weight of 242.36 g/mol, XLogP of 1.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone is sourced from PubChem (CID 119788483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).