4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one

C11H22N2O — CID 63104073

IUPAC4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one
SMILESCCCC(CN1CC(C)CC1=O)NC
InChIInChI=1S/C11H22N2O/c1-4-5-10(12-3)8-13-7-9(2)6-11(13)14/h9-10,12H,4-8H2,1-3H3
InChIKeyKQAAKXASMXCVGV-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.24
Rot. Bonds5

About 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one

4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one (PubChem CID 63104073) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one
PubChem CID63104073
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one
SMILESCCCC(CN1CC(C)CC1=O)NC
InChIInChI=1S/C11H22N2O/c1-4-5-10(12-3)8-13-7-9(2)6-11(13)14/h9-10,12H,4-8H2,1-3H3
InChIKeyKQAAKXASMXCVGV-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one?
The IUPAC name of 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one (CID 63104073) is 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one.
What is the SMILES notation for 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one?
The canonical SMILES for 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one is CCCC(CN1CC(C)CC1=O)NC.
What is the InChIKey of 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one?
The InChIKey is KQAAKXASMXCVGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-5-10(12-3)8-13-7-9(2)6-11(13)14/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one?
4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one has a molecular weight of 198.31 g/mol, XLogP of 1.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(methylamino)pentyl]pyrrolidin-2-one is sourced from PubChem (CID 63104073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).