2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide

C12H23N3O2 — CID 119324962

IUPAC2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide
SMILESCCCC(N)C(=O)NC1CCN(C(C)C)C1=O
InChIInChI=1S/C12H23N3O2/c1-4-5-9(13)11(16)14-10-6-7-15(8(2)3)12(10)17/h8-10H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyMTJAKFOHRDZBCZ-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.24
Rot. Bonds5

About 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide

2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide (PubChem CID 119324962) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide
PubChem CID119324962
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide
SMILESCCCC(N)C(=O)NC1CCN(C(C)C)C1=O
InChIInChI=1S/C12H23N3O2/c1-4-5-9(13)11(16)14-10-6-7-15(8(2)3)12(10)17/h8-10H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyMTJAKFOHRDZBCZ-UHFFFAOYSA-N
XLogP0.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-3,3-dimethyl-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide
CID 119785943
2-amino-N-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]pentanamide;hydrochloride
CID 119324342
2-amino-N-[1-(4-chlorophenyl)-2-oxopyrrolidin-3-yl]pentanamide
CID 119332076
2-amino-N-[1-(3,5-dimethoxyphenyl)-2-oxopyrrolidin-3-yl]pentanamide
CID 119341793
3-(hexan-3-ylamino)-1-propan-2-ylpyrrolidin-2-one
CID 115672858
(2R)-2-amino-4-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)pentanamide
CID 106255828
(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
CID 107569104
(2R)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
CID 103813279
cis-(1S,3R)-2,2-dimethyl-3-[(2-oxo-1-propan-2-ylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 122065600
(2S)-2-amino-N-(2-oxoazepan-3-yl)pentanamide
CID 107568483
2-amino-N-(4-propan-2-ylcyclohexyl)pentanamide
CID 119339852
(2R)-2-amino-N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]pentanamide
CID 107570093

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide?
The IUPAC name of 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide (CID 119324962) is 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide.
What is the SMILES notation for 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide?
The canonical SMILES for 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide is CCCC(N)C(=O)NC1CCN(C(C)C)C1=O.
What is the InChIKey of 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide?
The InChIKey is MTJAKFOHRDZBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-5-9(13)11(16)14-10-6-7-15(8(2)3)12(10)17/h8-10H,4-7,13H2,1-3H3,(H,14,16).
What are the key properties of 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide?
2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide has a molecular weight of 241.33 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pentanamide is sourced from PubChem (CID 119324962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).