N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide

C9H17N3O3 — CID 104597213

IUPACN-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide
SMILESCC1(C(=O)NOCC(N)=O)CCCCN1
InChIInChI=1S/C9H17N3O3/c1-9(4-2-3-5-11-9)8(14)12-15-6-7(10)13/h11H,2-6H2,1H3,(H2,10,13)(H,12,14)
InChIKeyFCNIHCHUQPXRFW-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.95
Rot. Bonds4

About N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide

N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide (PubChem CID 104597213) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide
PubChem CID104597213
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC NameN-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide
SMILESCC1(C(=O)NOCC(N)=O)CCCCN1
InChIInChI=1S/C9H17N3O3/c1-9(4-2-3-5-11-9)8(14)12-15-6-7(10)13/h11H,2-6H2,1H3,(H2,10,13)(H,12,14)
InChIKeyFCNIHCHUQPXRFW-UHFFFAOYSA-N
XLogP-0.95
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-prop-2-ynoxypiperidine-2-carboxamide
CID 130847325
2-[(2-methylpiperidine-2-carbonyl)amino]ethyl carbamate
CID 104597200
N-(2-amino-2-oxoethoxy)-2-propylpyrrolidine-2-carboxamide
CID 106975717
(2S)-5-amino-2-[(2-methylpiperidine-2-carbonyl)amino]-5-oxopentanoic acid
CID 104596611
N',N',2-trimethylpiperidine-2-carbohydrazide
CID 104597181
N-(1-hydroxy-2-methylpropan-2-yl)-2-methylpiperidine-2-carboxamide
CID 104596135
2-[1-[(2-methylpiperidine-2-carbonyl)amino]cyclobutyl]acetic acid
CID 113430878
N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-2-methylpiperidine-2-carboxamide
CID 104596903
N-[(1-hydroxycyclohexyl)methyl]-2-methylpyrrolidine-2-carboxamide
CID 65106651
N-[(2S)-1-hydroxypropan-2-yl]-2-methylpiperidine-2-carboxamide
CID 107218975
N-[3-(hydroxymethyl)pentan-3-yl]-2-methylpiperidine-2-carboxamide
CID 113430829
N-(2,3-dihydroxypropyl)-2-methylpiperidine-2-carboxamide
CID 104596953

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide (CID 104597213) is N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide is CC1(C(=O)NOCC(N)=O)CCCCN1.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide?
The InChIKey is FCNIHCHUQPXRFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-9(4-2-3-5-11-9)8(14)12-15-6-7(10)13/h11H,2-6H2,1H3,(H2,10,13)(H,12,14).
What are the key properties of N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide?
N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide has a molecular weight of 215.25 g/mol, XLogP of -0.95, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-2-methylpiperidine-2-carboxamide is sourced from PubChem (CID 104597213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).