2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide

C10H18N2O2 — CID 11217844

IUPAC2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide
SMILESCCC(C(N)=O)N1C(=O)CCC1(C)C
InChIInChI=1S/C10H18N2O2/c1-4-7(9(11)14)12-8(13)5-6-10(12,2)3/h7H,4-6H2,1-3H3,(H2,11,14)
InChIKeyUNRKOZSFBGOHHO-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.65
Rot. Bonds3

About 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide

2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide (PubChem CID 11217844) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide.

Molecular Properties

Compound Name2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide
PubChem CID11217844
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide
SMILESCCC(C(N)=O)N1C(=O)CCC1(C)C
InChIInChI=1S/C10H18N2O2/c1-4-7(9(11)14)12-8(13)5-6-10(12,2)3/h7H,4-6H2,1-3H3,(H2,11,14)
InChIKeyUNRKOZSFBGOHHO-UHFFFAOYSA-N
XLogP0.65
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide?
The IUPAC name of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide (CID 11217844) is 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide.
What is the SMILES notation for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide?
The canonical SMILES for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide is CCC(C(N)=O)N1C(=O)CCC1(C)C.
What is the InChIKey of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide?
The InChIKey is UNRKOZSFBGOHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-4-7(9(11)14)12-8(13)5-6-10(12,2)3/h7H,4-6H2,1-3H3,(H2,11,14).
What are the key properties of 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide?
2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide has a molecular weight of 198.27 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)butanamide is sourced from PubChem (CID 11217844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).