2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid

C15H24N2O4 — CID 43172528

IUPAC2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
SMILESCC(C)CN1CC(C(=O)NC(C)(C(=O)O)C2CC2)CC1=O
InChIInChI=1S/C15H24N2O4/c1-9(2)7-17-8-10(6-12(17)18)13(19)16-15(3,14(20)21)11-4-5-11/h9-11H,4-8H2,1-3H3,(H,16,19)(H,20,21)
InChIKeyMAUSIBCQBBDNGI-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.86
Rot. Bonds6

About 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid

2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid (PubChem CID 43172528) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
PubChem CID43172528
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
SMILESCC(C)CN1CC(C(=O)NC(C)(C(=O)O)C2CC2)CC1=O
InChIInChI=1S/C15H24N2O4/c1-9(2)7-17-8-10(6-12(17)18)13(19)16-15(3,14(20)21)11-4-5-11/h9-11H,4-8H2,1-3H3,(H,16,19)(H,20,21)
InChIKeyMAUSIBCQBBDNGI-UHFFFAOYSA-N
XLogP0.86
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid with MolForge

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Related Compounds

N-(3-methylbutyl)-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 47025507
N-(2-hydroxy-2-methylpentyl)-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 103713275
2-[(1-ethyl-5-oxopyrrolidine-3-carbonyl)amino]-2-methylbutanoic acid
CID 79793392
4-hydroxy-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]butanoic acid
CID 61244580
1-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]cyclopentane-1-carboxylic acid
CID 43169394
(3S)-1-(2-methylpropyl)-5-oxo-N-[2-(5-propyl-1,2,4-oxadiazol-3-yl)propan-2-yl]pyrrolidine-3-carboxamide
CID 95130069
1-(2-methylpropyl)-5-oxo-N-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 113182040
N-[4-(tert-butylcarbamoyl)phenyl]-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 46598239
(3S)-N-(2-bromoprop-2-enyl)-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 95254623
N-(4-hydroxy-2-methylbutyl)-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 66109437
1-[[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]methyl]cyclobutane-1-carboxylic acid
CID 81369448
2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]hexanoic acid
CID 43469719

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid?
The IUPAC name of 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid (CID 43172528) is 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid.
What is the SMILES notation for 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid?
The canonical SMILES for 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid is CC(C)CN1CC(C(=O)NC(C)(C(=O)O)C2CC2)CC1=O.
What is the InChIKey of 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid?
The InChIKey is MAUSIBCQBBDNGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-9(2)7-17-8-10(6-12(17)18)13(19)16-15(3,14(20)21)11-4-5-11/h9-11H,4-8H2,1-3H3,(H,16,19)(H,20,21).
What are the key properties of 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid?
2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid has a molecular weight of 296.37 g/mol, XLogP of 0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[[1-(2-methylpropyl)-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid is sourced from PubChem (CID 43172528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).