1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione

C14H17N3O2 — CID 43636781

IUPAC1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione
SMILESCC(NC1CC(=O)N(C2CC2)C1=O)c1ccccn1
InChIInChI=1S/C14H17N3O2/c1-9(11-4-2-3-7-15-11)16-12-8-13(18)17(14(12)19)10-5-6-10/h2-4,7,9-10,12,16H,5-6,8H2,1H3
InChIKeyZWSKFYBJFBHOES-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.02
Rot. Bonds4

About 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione

1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione (PubChem CID 43636781) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione
PubChem CID43636781
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione
SMILESCC(NC1CC(=O)N(C2CC2)C1=O)c1ccccn1
InChIInChI=1S/C14H17N3O2/c1-9(11-4-2-3-7-15-11)16-12-8-13(18)17(14(12)19)10-5-6-10/h2-4,7,9-10,12,16H,5-6,8H2,1H3
InChIKeyZWSKFYBJFBHOES-UHFFFAOYSA-N
XLogP1.02
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1-cyclopropyl-3-[1-(4-methylphenyl)ethylamino]pyrrolidine-2,5-dione
CID 60934095
1-cyclopropyl-3-(propan-2-ylamino)pyrrolidine-2,5-dione
CID 43636083
1-cyclopropyl-3-(3-methylbutan-2-ylamino)pyrrolidine-2,5-dione
CID 43636669
1-cyclopropyl-3-[(2-methyl-3-pyridinyl)amino]pyrrolidine-2,5-dione
CID 79041651
1-cyclopropyl-5-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine
CID 115705804
1,1-dioxo-N-(1-pyridin-2-ylethyl)thian-4-amine
CID 43511597
N-[(1S)-1-pyridin-2-ylethyl]cycloheptanamine
CID 28647798
N-[(1S)-1-pyridin-2-ylethyl]cyclododecanamine
CID 29052683
N-(1-pyridin-2-ylethyl)cyclooctanamine
CID 43178142
1-[4-(1-pyridin-2-ylethylamino)piperidin-1-yl]ethanone
CID 43223671
1-cyclopentyl-3-(2-pyridin-2-ylethylamino)pyrrolidine-2,5-dione
CID 43637482
N,N-dimethyl-4-[[(1S)-1-pyridin-2-ylethyl]amino]piperidine-1-carboxamide
CID 83262155

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione (CID 43636781) is 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione is CC(NC1CC(=O)N(C2CC2)C1=O)c1ccccn1.
What is the InChIKey of 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione?
The InChIKey is ZWSKFYBJFBHOES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9(11-4-2-3-7-15-11)16-12-8-13(18)17(14(12)19)10-5-6-10/h2-4,7,9-10,12,16H,5-6,8H2,1H3.
What are the key properties of 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione?
1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione has a molecular weight of 259.31 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-pyridin-2-ylethylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 43636781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).