(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide

C9H17N3O2 — CID 106187633

IUPAC(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
SMILESCCC[C@H](N)C(=O)NC1CNC(=O)C1
InChIInChI=1S/C9H17N3O2/c1-2-3-7(10)9(14)12-6-4-8(13)11-5-6/h6-7H,2-5,10H2,1H3,(H,11,13)(H,12,14)/t6?,7-/m0/s1
InChIKeyVTXJOYJVRATGDS-MLWJPKLSSA-N
MW199.25 g/mol
LogP-0.88
Rot. Bonds4

About (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide

(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide (PubChem CID 106187633) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
PubChem CID106187633
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
SMILESCCC[C@H](N)C(=O)NC1CNC(=O)C1
InChIInChI=1S/C9H17N3O2/c1-2-3-7(10)9(14)12-6-4-8(13)11-5-6/h6-7H,2-5,10H2,1H3,(H,11,13)(H,12,14)/t6?,7-/m0/s1
InChIKeyVTXJOYJVRATGDS-MLWJPKLSSA-N
XLogP-0.88
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(6-oxopiperidin-3-yl)pentanamide
CID 63661228
(2S)-2-amino-4-methylsulfanyl-N-(5-oxopyrrolidin-3-yl)butanamide
CID 106187684
(2R)-2-amino-4-methyl-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187627
2-carbamothioyl-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106189156
(2R)-2-[(5-oxopyrrolidin-3-yl)carbamoylamino]pentanoic acid
CID 106192089
3-amino-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106187621
2-amino-N-(5-oxopyrrolidin-3-yl)-3-phenylpropanamide
CID 106187812
5-amino-N-(5-oxopyrrolidin-3-yl)hexanamide
CID 106187716
1-amino-3-(5-oxopyrrolidin-3-yl)urea
CID 106197369
(2S)-2-acetamido-N-[(3S)-5-oxopyrrolidin-3-yl]propanamide;propane
CID 144964552
4-[2-[(5-oxopyrrolidin-3-yl)carbamoylamino]ethyl]heptanoic acid
CID 106191609
4-hydroxy-N-(5-oxopyrrolidin-3-yl)pentanamide
CID 106197992

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide?
The IUPAC name of (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide (CID 106187633) is (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide is CCC[C@H](N)C(=O)NC1CNC(=O)C1.
What is the InChIKey of (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide?
The InChIKey is VTXJOYJVRATGDS-MLWJPKLSSA-N. The full InChI is InChI=1S/C9H17N3O2/c1-2-3-7(10)9(14)12-6-4-8(13)11-5-6/h6-7H,2-5,10H2,1H3,(H,11,13)(H,12,14)/t6?,7-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide?
(2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide has a molecular weight of 199.25 g/mol, XLogP of -0.88, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(5-oxopyrrolidin-3-yl)pentanamide is sourced from PubChem (CID 106187633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).