3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide

C11H21N3O2 — CID 106187499

IUPAC3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
SMILESCC(C)(C)NCCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C11H21N3O2/c1-11(2,3)13-5-4-9(15)14-8-6-10(16)12-7-8/h8,13H,4-7H2,1-3H3,(H,12,16)(H,14,15)
InChIKeyJBXCFZJEUYXDMD-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.23
Rot. Bonds4

About 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide

3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide (PubChem CID 106187499) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide.

Molecular Properties

Compound Name3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
PubChem CID106187499
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
SMILESCC(C)(C)NCCC(=O)NC1CNC(=O)C1
InChIInChI=1S/C11H21N3O2/c1-11(2,3)13-5-4-9(15)14-8-6-10(16)12-7-8/h8,13H,4-7H2,1-3H3,(H,12,16)(H,14,15)
InChIKeyJBXCFZJEUYXDMD-UHFFFAOYSA-N
XLogP-0.23
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-(5-oxopyrrolidin-3-yl)propanamide
CID 106187570
4-[2-(tert-butylamino)ethylamino]pyrrolidin-2-one
CID 106182603
2-chloro-N-(5-oxopyrrolidin-3-yl)acetamide
CID 106186093
4-hydroxy-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106197992
2,2-dimethyl-N-[3-oxo-3-[(6-oxopiperidin-3-yl)amino]propyl]propanamide
CID 62897735
5-amino-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 106187716
tert-butyl N-[(3R)-5-oxopyrrolidin-3-yl]carbamate
CID 71301758
3-(tert-butylamino)-N-(4-methylcyclohexyl)propanamide
CID 54928774
N-(5-oxopyrrolidin-3-yl)-2-(propan-2-ylamino)acetamide
CID 106187640
3-(tert-butylamino)-N-(2-oxopiperidin-3-yl)propanamide
CID 55033831
N-(5-oxopyrrolidin-3-yl)-3-piperidin-1-ylpropanamide
CID 112534676
4-(2-aminoethyl)-5-methyl-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 114155694

Frequently Asked Questions

What is the IUPAC name of 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The IUPAC name of 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide (CID 106187499) is 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide.
What is the SMILES notation for 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The canonical SMILES for 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide is CC(C)(C)NCCC(=O)NC1CNC(=O)C1.
What is the InChIKey of 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
The InChIKey is JBXCFZJEUYXDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-11(2,3)13-5-4-9(15)14-8-6-10(16)12-7-8/h8,13H,4-7H2,1-3H3,(H,12,16)(H,14,15).
What are the key properties of 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide?
3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide has a molecular weight of 227.31 g/mol, XLogP of -0.23, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tert-butylamino)-N-(5-oxopyrrolidin-3-yl)propanamide is sourced from PubChem (CID 106187499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).