N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide

C18H19N3O3 — CID 78850429

IUPACN-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CC1)C1CCCN1C(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C18H19N3O3/c22-16-10-13(12-4-1-2-5-14(12)20-16)18(24)21-9-3-6-15(21)17(23)19-11-7-8-11/h1-2,4-5,10-11,15H,3,6-9H2,(H,19,23)(H,20,22)
InChIKeyGEIVVUQFYAIFIO-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.41
Rot. Bonds3

About N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide

N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 78850429) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide
PubChem CID78850429
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC NameN-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CC1)C1CCCN1C(=O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C18H19N3O3/c22-16-10-13(12-4-1-2-5-14(12)20-16)18(24)21-9-3-6-15(21)17(23)19-11-7-8-11/h1-2,4-5,10-11,15H,3,6-9H2,(H,19,23)(H,20,22)
InChIKeyGEIVVUQFYAIFIO-UHFFFAOYSA-N
XLogP1.41
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide (CID 78850429) is N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide is O=C(NC1CC1)C1CCCN1C(=O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is GEIVVUQFYAIFIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c22-16-10-13(12-4-1-2-5-14(12)20-16)18(24)21-9-3-6-15(21)17(23)19-11-7-8-11/h1-2,4-5,10-11,15H,3,6-9H2,(H,19,23)(H,20,22).
What are the key properties of N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide?
N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2-oxo-1H-quinoline-4-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 78850429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).