N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide

C12H23N3O3 — CID 61265439

IUPACN-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C(=O)C(C)(C)N)CC1
InChIInChI=1S/C12H23N3O3/c1-12(2,13)11(17)15-6-4-9(5-7-15)14-10(16)8-18-3/h9H,4-8,13H2,1-3H3,(H,14,16)
InChIKeySSGIYQSZMGKKSX-UHFFFAOYSA-N
MW257.33 g/mol
LogP-0.52
Rot. Bonds4

About N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide

N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide (PubChem CID 61265439) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide
PubChem CID61265439
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC NameN-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC1CCN(C(=O)C(C)(C)N)CC1
InChIInChI=1S/C12H23N3O3/c1-12(2,13)11(17)15-6-4-9(5-7-15)14-10(16)8-18-3/h9H,4-8,13H2,1-3H3,(H,14,16)
InChIKeySSGIYQSZMGKKSX-UHFFFAOYSA-N
XLogP-0.52
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(ethylamino)-2-methylpropanoyl]piperidin-4-yl]-2-methoxyacetamide
CID 62836448
N-[1-(1-aminocyclopropanecarbonyl)piperidin-4-yl]-2-methoxyacetamide
CID 65466624
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(2-methoxyethoxy)acetamide
CID 108557795
2-amino-N-[1-(2-methoxyacetyl)piperidin-4-yl]-2-methylpropanamide
CID 61266193
N-[1-(2-bromoacetyl)piperidin-4-yl]-2-methoxyacetamide
CID 63680285
N-[1-(4-aminobutanoyl)piperidin-4-yl]-2-methoxyacetamide
CID 54872286
4-[4-[(2-methoxyacetyl)amino]piperidin-1-yl]-4-oxobutanoic acid
CID 54875415
N,N-diethyl-4-[(2-methoxyacetyl)amino]piperidine-1-carboxamide
CID 108562550
N-[1-[2-(azetidin-3-yl)acetyl]piperidin-4-yl]-2-methoxyacetamide
CID 64611592
N-[1-(5-bromopentanoyl)piperidin-4-yl]-2-methoxyacetamide
CID 114014853
[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate
CID 46812470
2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide
CID 90442595

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide?
The IUPAC name of N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide (CID 61265439) is N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide?
The canonical SMILES for N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide is COCC(=O)NC1CCN(C(=O)C(C)(C)N)CC1.
What is the InChIKey of N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide?
The InChIKey is SSGIYQSZMGKKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-12(2,13)11(17)15-6-4-9(5-7-15)14-10(16)8-18-3/h9H,4-8,13H2,1-3H3,(H,14,16).
What are the key properties of N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide?
N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide has a molecular weight of 257.33 g/mol, XLogP of -0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-methylpropanoyl)piperidin-4-yl]-2-methoxyacetamide is sourced from PubChem (CID 61265439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).