N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide

C11H21N3O2 — CID 55220524

IUPACN-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide
SMILESCCC1(C(=O)N(C)CC(N)=O)CCNCC1
InChIInChI=1S/C11H21N3O2/c1-3-11(4-6-13-7-5-11)10(16)14(2)8-9(12)15/h13H,3-8H2,1-2H3,(H2,12,15)
InChIKeyDBPUGHNFHUQPRG-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.29
Rot. Bonds4

About N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide

N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide (PubChem CID 55220524) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide
PubChem CID55220524
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide
SMILESCCC1(C(=O)N(C)CC(N)=O)CCNCC1
InChIInChI=1S/C11H21N3O2/c1-3-11(4-6-13-7-5-11)10(16)14(2)8-9(12)15/h13H,3-8H2,1-2H3,(H2,12,15)
InChIKeyDBPUGHNFHUQPRG-UHFFFAOYSA-N
XLogP-0.29
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide (CID 55220524) is N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide is CCC1(C(=O)N(C)CC(N)=O)CCNCC1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide?
The InChIKey is DBPUGHNFHUQPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-3-11(4-6-13-7-5-11)10(16)14(2)8-9(12)15/h13H,3-8H2,1-2H3,(H2,12,15).
What are the key properties of N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide?
N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide has a molecular weight of 227.31 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-4-ethyl-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 55220524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).