N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide

C15H19N3O4 — CID 166161060

IUPACN-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2ccnc(N3CCC(O)C3=O)c2)O1
InChIInChI=1S/C15H19N3O4/c1-9-2-3-12(22-9)14(20)17-10-4-6-16-13(8-10)18-7-5-11(19)15(18)21/h4,6,8-9,11-12,19H,2-3,5,7H2,1H3,(H,16,17,20)
InChIKeyZERIANFLHQGKAI-UHFFFAOYSA-N
MW305.33 g/mol
LogP0.69
Rot. Bonds3

About N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide

N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide (PubChem CID 166161060) has the molecular formula C15H19N3O4 and a molecular weight of 305.33 g/mol. Its IUPAC name is N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
PubChem CID166161060
Molecular FormulaC15H19N3O4
Molecular Weight305.33 g/mol
Exact Mass305.14
IUPAC NameN-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2ccnc(N3CCC(O)C3=O)c2)O1
InChIInChI=1S/C15H19N3O4/c1-9-2-3-12(22-9)14(20)17-10-4-6-16-13(8-10)18-7-5-11(19)15(18)21/h4,6,8-9,11-12,19H,2-3,5,7H2,1H3,(H,16,17,20)
InChIKeyZERIANFLHQGKAI-UHFFFAOYSA-N
XLogP0.69
TPSA91.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The IUPAC name of N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide (CID 166161060) is N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide.
What is the SMILES notation for N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The canonical SMILES for N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide is CC1CCC(C(=O)Nc2ccnc(N3CCC(O)C3=O)c2)O1.
What is the InChIKey of N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The InChIKey is ZERIANFLHQGKAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O4/c1-9-2-3-12(22-9)14(20)17-10-4-6-16-13(8-10)18-7-5-11(19)15(18)21/h4,6,8-9,11-12,19H,2-3,5,7H2,1H3,(H,16,17,20).
What are the key properties of N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide has a molecular weight of 305.33 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 166161060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).