N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide

C12H23N3O2 — CID 83079558

IUPACN-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(CC(N)=O)C(C)C)CCCN1
InChIInChI=1S/C12H23N3O2/c1-4-12(6-5-7-14-12)11(17)15(9(2)3)8-10(13)16/h9,14H,4-8H2,1-3H3,(H2,13,16)
InChIKeySUEXONAFXLDJGW-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.24
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide

N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide (PubChem CID 83079558) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide
PubChem CID83079558
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)N(CC(N)=O)C(C)C)CCCN1
InChIInChI=1S/C12H23N3O2/c1-4-12(6-5-7-14-12)11(17)15(9(2)3)8-10(13)16/h9,14H,4-8H2,1-3H3,(H2,13,16)
InChIKeySUEXONAFXLDJGW-UHFFFAOYSA-N
XLogP0.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.24
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)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide (CID 83079558) is N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide is CCC1(C(=O)N(CC(N)=O)C(C)C)CCCN1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide?
The InChIKey is SUEXONAFXLDJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-12(6-5-7-14-12)11(17)15(9(2)3)8-10(13)16/h9,14H,4-8H2,1-3H3,(H2,13,16).
What are the key properties of N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide?
N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.24, 5 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)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 83079558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).