N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide

C13H25N3O3 — CID 106236621

IUPACN-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)NCCOCC(N)=O)C1CCCNC1
InChIInChI=1S/C13H25N3O3/c1-13(2,10-4-3-5-15-8-10)12(18)16-6-7-19-9-11(14)17/h10,15H,3-9H2,1-2H3,(H2,14,17)(H,16,18)
InChIKeyQRGSXIQICZPHBY-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.37
Rot. Bonds7

About N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide

N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide (PubChem CID 106236621) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
PubChem CID106236621
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC NameN-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESCC(C)(C(=O)NCCOCC(N)=O)C1CCCNC1
InChIInChI=1S/C13H25N3O3/c1-13(2,10-4-3-5-15-8-10)12(18)16-6-7-19-9-11(14)17/h10,15H,3-9H2,1-2H3,(H2,14,17)(H,16,18)
InChIKeyQRGSXIQICZPHBY-UHFFFAOYSA-N
XLogP-0.37
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
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-but-3-enoxyethyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 106398324
N-[3-(2-methoxyethylamino)-3-oxopropyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 115881596
N-[2-(diethylamino)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031262
2,2-dimethyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanamide
CID 103884926
2-methyl-N-[3-oxo-3-(propan-2-ylamino)propyl]-2-piperidin-3-ylpropanamide
CID 115881590
2-methyl-N-(2-methylpropyl)-2-piperidin-3-ylpropanamide
CID 83032464
N-(3-ethylsulfanylpropyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 114247975
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239
2-methyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanoic acid
CID 83198731
2-[[(2-methyl-2-piperidin-3-ylpropanoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 83199902
(2R)-4-amino-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]-4-oxobutanoic acid
CID 107824520
N-(2-amino-2-oxoethyl)-N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83198334

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The IUPAC name of N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide (CID 106236621) is N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide is CC(C)(C(=O)NCCOCC(N)=O)C1CCCNC1.
What is the InChIKey of N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The InChIKey is QRGSXIQICZPHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-13(2,10-4-3-5-15-8-10)12(18)16-6-7-19-9-11(14)17/h10,15H,3-9H2,1-2H3,(H2,14,17)(H,16,18).
What are the key properties of N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide?
N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide has a molecular weight of 271.36 g/mol, XLogP of -0.37, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-2-oxoethoxy)ethyl]-2-methyl-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 106236621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).