(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide

C9H17N3O2 — CID 103807490

IUPAC(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(N)CNC(=O)[C@@H]1CCC(=O)N1
InChIInChI=1S/C9H17N3O2/c1-9(2,10)5-11-8(14)6-3-4-7(13)12-6/h6H,3-5,10H2,1-2H3,(H,11,14)(H,12,13)/t6-/m0/s1
InChIKeyOJSGCYFOOHUEDF-LURJTMIESA-N
MW199.25 g/mol
LogP-0.88
Rot. Bonds3

About (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide

(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide (PubChem CID 103807490) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide
PubChem CID103807490
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide
SMILESCC(C)(N)CNC(=O)[C@@H]1CCC(=O)N1
InChIInChI=1S/C9H17N3O2/c1-9(2,10)5-11-8(14)6-3-4-7(13)12-6/h6H,3-5,10H2,1-2H3,(H,11,14)(H,12,13)/t6-/m0/s1
InChIKeyOJSGCYFOOHUEDF-LURJTMIESA-N
XLogP-0.88
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
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

(2S)-N-(3-amino-2,2-difluoropropyl)-5-oxopyrrolidine-2-carboxamide
CID 104954938
N-(2-hydroxy-2-phenylpropyl)-5-oxopyrrolidine-2-carboxamide
CID 110663932
N-(cyanomethyl)-5-oxopyrrolidine-2-carboxamide
CID 515622
(2S)-N-[2-(methylamino)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 94537622
N-[2-(2-fluorophenyl)-2-methylpropyl]-5-oxopyrrolidine-2-carboxamide
CID 110445241
5-oxo-N-[2-[2-[(5-oxopyrrolidine-2-carbonyl)amino]ethylamino]ethyl]pyrrolidine-2-carboxamide
CID 155810723
N-(2-methoxyethyl)-5-oxopyrrolidine-2-carboxamide
CID 110689650
(2S)-N-(3-aminopropyl)-5-oxopyrrolidine-2-carboxamide
CID 103805016
N-(2-aminobutyl)-5-oxopyrrolidine-2-carboxamide
CID 63731996
N-[(4-tert-butylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110793335
2-[[(2S)-5-oxopyrrolidine-2-carbonyl]amino]acetate
CID 11902929
N-(3-methylbutyl)-5-oxopyrrolidine-2-carboxamide
CID 110689693

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide (CID 103807490) is (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide is CC(C)(N)CNC(=O)[C@@H]1CCC(=O)N1.
What is the InChIKey of (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide?
The InChIKey is OJSGCYFOOHUEDF-LURJTMIESA-N. The full InChI is InChI=1S/C9H17N3O2/c1-9(2,10)5-11-8(14)6-3-4-7(13)12-6/h6H,3-5,10H2,1-2H3,(H,11,14)(H,12,13)/t6-/m0/s1.
What are the key properties of (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide?
(2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide has a molecular weight of 199.25 g/mol, XLogP of -0.88, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-amino-2-methylpropyl)-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 103807490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).