methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate

C9H17N3O3 — CID 60801559

IUPACmethyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate
SMILESCOC(=O)N(CC(N)=O)C1CCCNC1
InChIInChI=1S/C9H17N3O3/c1-15-9(14)12(6-8(10)13)7-3-2-4-11-5-7/h7,11H,2-6H2,1H3,(H2,10,13)
InChIKeyAXZWERMKCFCDHH-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.71
Rot. Bonds3

About methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate

methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate (PubChem CID 60801559) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate.

Molecular Properties

Compound Namemethyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate
PubChem CID60801559
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Namemethyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate
SMILESCOC(=O)N(CC(N)=O)C1CCCNC1
InChIInChI=1S/C9H17N3O3/c1-15-9(14)12(6-8(10)13)7-3-2-4-11-5-7/h7,11H,2-6H2,1H3,(H2,10,13)
InChIKeyAXZWERMKCFCDHH-UHFFFAOYSA-N
XLogP-0.71
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[acetyl(piperidin-3-yl)amino]acetamide
CID 60802262
2-[(2-methoxyacetyl)-piperidin-3-ylamino]acetamide
CID 61277569
2-acetamido-N-(2-amino-2-oxoethyl)-N-piperidin-3-ylacetamide
CID 60799984
N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcyclopentanecarboxamide
CID 60801225
2-[[2-[(2-methylpropan-2-yl)oxy]acetyl]-piperidin-3-ylamino]acetamide
CID 112602463
2-[piperidin-3-yl-(2-propoxyacetyl)amino]acetamide
CID 107938528
N-(2-amino-2-oxoethyl)-2,2-dimethyl-N-piperidin-3-ylbutanamide
CID 55103248
N-(2-amino-2-oxoethyl)-N-piperidin-3-yl-2-propylpentanamide
CID 82985484
N-(2-amino-2-oxoethyl)-1-methyl-N-piperidin-3-ylpyrazole-4-carboxamide
CID 60800702
N-(2-amino-2-oxoethyl)-3-(oxolan-2-yl)-N-piperidin-3-ylpropanamide
CID 65156815
N-(2-amino-2-oxoethyl)-N-pyrrolidin-3-ylcyclopropanecarboxamide
CID 60806195
N-(2-amino-2-oxoethyl)-2,5-dimethyl-N-piperidin-3-ylbenzamide
CID 60800165

Frequently Asked Questions

What is the IUPAC name of methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate?
The IUPAC name of methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate (CID 60801559) is methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate.
What is the SMILES notation for methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate?
The canonical SMILES for methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate is COC(=O)N(CC(N)=O)C1CCCNC1.
What is the InChIKey of methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate?
The InChIKey is AXZWERMKCFCDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-15-9(14)12(6-8(10)13)7-3-2-4-11-5-7/h7,11H,2-6H2,1H3,(H2,10,13).
What are the key properties of methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate?
methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate has a molecular weight of 215.25 g/mol, XLogP of -0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-amino-2-oxoethyl)-N-piperidin-3-ylcarbamate is sourced from PubChem (CID 60801559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).