N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide

C11H21N3O2 — CID 106188940

IUPACN,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide
SMILESCCN(CC)C(=O)C(C)NC1CNC(=O)C1
InChIInChI=1S/C11H21N3O2/c1-4-14(5-2)11(16)8(3)13-9-6-10(15)12-7-9/h8-9,13H,4-7H2,1-3H3,(H,12,15)
InChIKeyCDLYXSUUNUSVEC-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.28
Rot. Bonds5

About N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide

N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide (PubChem CID 106188940) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide
PubChem CID106188940
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide
SMILESCCN(CC)C(=O)C(C)NC1CNC(=O)C1
InChIInChI=1S/C11H21N3O2/c1-4-14(5-2)11(16)8(3)13-9-6-10(15)12-7-9/h8-9,13H,4-7H2,1-3H3,(H,12,15)
InChIKeyCDLYXSUUNUSVEC-UHFFFAOYSA-N
XLogP-0.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,5-dioxopyrrolidin-3-yl)amino]-N,N-diethylpropanamide
CID 113408373
2-(cyclopropylamino)-N,N-diethylpropanamide
CID 43113043
2-[(5-oxopyrrolidin-3-yl)amino]butanoic acid
CID 106184659
4-(3-hydroxybutan-2-ylamino)pyrrolidin-2-one
CID 106189044
2-(cycloheptylamino)-N,N-diethylpropanamide
CID 43132181
N,N-diethyl-2-[(3-propan-2-ylcyclobutyl)amino]propanamide
CID 103561513
(2S)-2-acetamido-N-[(3S)-5-oxopyrrolidin-3-yl]propanamide;propane
CID 144964552
2-[(6-oxopiperidin-3-yl)amino]-N-pentan-3-ylpropanamide
CID 63662471
3-[ethyl-[(6-oxopiperidin-3-yl)carbamoyl]amino]-2-methylpropanoic acid
CID 55232480
N-ethyl-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 78981630
(4R)-4-(2-methylpropylamino)pyrrolidin-2-one
CID 139457725
4-(1-cyclobutylethylamino)pyrrolidin-2-one
CID 130978828

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide?
The IUPAC name of N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide (CID 106188940) is N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide.
What is the SMILES notation for N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide?
The canonical SMILES for N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide is CCN(CC)C(=O)C(C)NC1CNC(=O)C1.
What is the InChIKey of N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide?
The InChIKey is CDLYXSUUNUSVEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-4-14(5-2)11(16)8(3)13-9-6-10(15)12-7-9/h8-9,13H,4-7H2,1-3H3,(H,12,15).
What are the key properties of N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide?
N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide has a molecular weight of 227.31 g/mol, XLogP of -0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(5-oxopyrrolidin-3-yl)amino]propanamide is sourced from PubChem (CID 106188940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).