2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide

C12H25N3O2 — CID 115707984

IUPAC2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CCN(C)CC1C
InChIInChI=1S/C12H25N3O2/c1-10-9-15(2)6-4-11(10)14-8-12(16)13-5-7-17-3/h10-11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyRLOZEAHCBLBAHJ-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.32
Rot. Bonds6

About 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide

2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 115707984) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID115707984
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CCN(C)CC1C
InChIInChI=1S/C12H25N3O2/c1-10-9-15(2)6-4-11(10)14-8-12(16)13-5-7-17-3/h10-11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyRLOZEAHCBLBAHJ-UHFFFAOYSA-N
XLogP-0.32
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-[(2-methylcyclohexyl)amino]acetamide
CID 60646854
N-(2-methoxyethyl)-2-[(2-methylcyclopropyl)amino]acetamide
CID 62396936
N-(4-chlorophenyl)-2-[(1,3-dimethylpiperidin-4-yl)amino]acetamide
CID 115713823
2-[(1,3-dimethylpiperidin-4-yl)amino]ethanol
CID 115707421
2-[(1,3-dimethylpiperidin-4-yl)amino]-N-ethyl-N-methylacetamide
CID 114448901
N-(2-methoxyethyl)-2-[(1-propan-2-ylpyrrolidin-3-yl)amino]acetamide
CID 112698333
4-[(1,3-dimethylpiperidin-4-yl)amino]butanoic acid
CID 114503544
methyl 2-bromo-3-[(1,3-dimethylpiperidin-4-yl)amino]propanoate
CID 103268568
1,3-dimethyl-N-(2-methylidenebutyl)piperidin-4-amine
CID 114503399
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(2-methoxyethyl)propanamide
CID 112701684
2-[(1-ethylpyrrolidin-3-yl)methylamino]-N-(2-methoxyethyl)acetamide
CID 54956631
1-[2-[(1,3-dimethylpiperidin-4-yl)amino]acetyl]piperidine-4-carboxylic acid
CID 103268593

Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide (CID 115707984) is 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNC1CCN(C)CC1C.
What is the InChIKey of 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is RLOZEAHCBLBAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-10-9-15(2)6-4-11(10)14-8-12(16)13-5-7-17-3/h10-11,14H,4-9H2,1-3H3,(H,13,16).
What are the key properties of 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide?
2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 243.35 g/mol, XLogP of -0.32, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-dimethylpiperidin-4-yl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 115707984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).