3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide

C9H17N3O2 — CID 106187570

IUPAC3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
SMILESCCNCCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C9H17N3O2/c1-2-10-4-3-8(13)12-7-5-9(14)11-6-7/h7,10H,2-6H2,1H3,(H,11,14)(H,12,13)
InChIKeyASGFOURQNRWPRY-UHFFFAOYSA-N
MW199.25 g/mol
LogP-1.01
Rot. Bonds5

About 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide

3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide (PubChem CID 106187570) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
PubChem CID106187570
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
SMILESCCNCCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C9H17N3O2/c1-2-10-4-3-8(13)12-7-5-9(14)11-6-7/h7,10H,2-6H2,1H3,(H,11,14)(H,12,13)
InChIKeyASGFOURQNRWPRY-UHFFFAOYSA-N
XLogP-1.01
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-1.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
CID 106187499
2-chloro-N-(5-oxopyrrolidin-3-yl)acetamide
CID 106186093
4-hydroxy-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106197992
5-amino-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 106187716
3-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187621
N-(5-oxopyrrolidin-3-yl)-2-(propan-2-ylamino)acetamide
CID 106187640
N-(5-oxopyrrolidin-3-yl)-3-piperidin-1-ylpropanamide
CID 112534676
4-(2-aminoethyl)-5-methyl-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 114155694
1-(2-hydroxyethyl)-3-(5-oxopyrrolidin-3-yl)urea
CID 130625812
6-[(5-oxopyrrolidin-3-yl)carbamoylamino]hexanoic acid
CID 106191828
2,2-dimethyl-N-[3-oxo-3-[(6-oxopiperidin-3-yl)amino]propyl]propanamide
CID 62897735
(2R)-2-amino-4-methyl-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187627

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The IUPAC name of 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide (CID 106187570) is 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide.
What is the SMILES notation for 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The canonical SMILES for 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide is CCNCCC(=O)NC1CNC(=O)C1.
What is the InChIKey of 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The InChIKey is ASGFOURQNRWPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-2-10-4-3-8(13)12-7-5-9(14)11-6-7/h7,10H,2-6H2,1H3,(H,11,14)(H,12,13).
What are the key properties of 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide has a molecular weight of 199.25 g/mol, XLogP of -1.01, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide is sourced from PubChem (CID 106187570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).