1-methyl-5-oxopyrrolidine-3-carboxamide

C6H10N2O2 — CID 541476

IUPAC1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(N)=O)CC1=O
InChIInChI=1S/C6H10N2O2/c1-8-3-4(6(7)10)2-5(8)9/h4H,2-3H2,1H3,(H2,7,10)
InChIKeyXDNQKOAFGDBANV-UHFFFAOYSA-N
MW142.16 g/mol
LogP-1.05
Rot. Bonds1

About 1-methyl-5-oxopyrrolidine-3-carboxamide

1-methyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 541476) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 1-methyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-5-oxopyrrolidine-3-carboxamide
PubChem CID541476
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name1-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(N)=O)CC1=O
InChIInChI=1S/C6H10N2O2/c1-8-3-4(6(7)10)2-5(8)9/h4H,2-3H2,1H3,(H2,7,10)
InChIKeyXDNQKOAFGDBANV-UHFFFAOYSA-N
XLogP-1.05
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-methyl-5-oxopyrrolidine-3-carboxamide (CID 541476) is 1-methyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-methyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-methyl-5-oxopyrrolidine-3-carboxamide is CN1CC(C(N)=O)CC1=O.
What is the InChIKey of 1-methyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is XDNQKOAFGDBANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-8-3-4(6(7)10)2-5(8)9/h4H,2-3H2,1H3,(H2,7,10).
What are the key properties of 1-methyl-5-oxopyrrolidine-3-carboxamide?
1-methyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 142.16 g/mol, XLogP of -1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 541476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).