N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide

C10H16N2O3 — CID 82841949

IUPACN-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCC1OCCC1NC(=O)C1CNC(=O)C1
InChIInChI=1S/C10H16N2O3/c1-6-8(2-3-15-6)12-10(14)7-4-9(13)11-5-7/h6-8H,2-5H2,1H3,(H,11,13)(H,12,14)
InChIKeyZWKAAGCAQHELSG-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.58
Rot. Bonds2

About N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide

N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 82841949) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID82841949
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC NameN-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCC1OCCC1NC(=O)C1CNC(=O)C1
InChIInChI=1S/C10H16N2O3/c1-6-8(2-3-15-6)12-10(14)7-4-9(13)11-5-7/h6-8H,2-5H2,1H3,(H,11,13)(H,12,14)
InChIKeyZWKAAGCAQHELSG-UHFFFAOYSA-N
XLogP-0.58
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide (CID 82841949) is N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide is CC1OCCC1NC(=O)C1CNC(=O)C1.
What is the InChIKey of N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is ZWKAAGCAQHELSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-6-8(2-3-15-6)12-10(14)7-4-9(13)11-5-7/h6-8H,2-5H2,1H3,(H,11,13)(H,12,14).
What are the key properties of N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide?
N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 212.25 g/mol, XLogP of -0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyloxolan-3-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 82841949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).