3-methyl-3-(methylaminomethyl)pyrrolidin-2-one

C7H14N2O — CID 169259581

IUPAC3-methyl-3-(methylaminomethyl)pyrrolidin-2-one
SMILESCNCC1(C)CCNC1=O
InChIInChI=1S/C7H14N2O/c1-7(5-8-2)3-4-9-6(7)10/h8H,3-5H2,1-2H3,(H,9,10)
InChIKeyBLXKTNQMLUCJQZ-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.27
Rot. Bonds2

About 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one

3-methyl-3-(methylaminomethyl)pyrrolidin-2-one (PubChem CID 169259581) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name3-methyl-3-(methylaminomethyl)pyrrolidin-2-one
PubChem CID169259581
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name3-methyl-3-(methylaminomethyl)pyrrolidin-2-one
SMILESCNCC1(C)CCNC1=O
InChIInChI=1S/C7H14N2O/c1-7(5-8-2)3-4-9-6(7)10/h8H,3-5H2,1-2H3,(H,9,10)
InChIKeyBLXKTNQMLUCJQZ-UHFFFAOYSA-N
XLogP-0.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one?
The IUPAC name of 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one (CID 169259581) is 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one.
What is the SMILES notation for 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one?
The canonical SMILES for 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one is CNCC1(C)CCNC1=O.
What is the InChIKey of 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one?
The InChIKey is BLXKTNQMLUCJQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7(5-8-2)3-4-9-6(7)10/h8H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one?
3-methyl-3-(methylaminomethyl)pyrrolidin-2-one has a molecular weight of 142.20 g/mol, XLogP of -0.27, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(methylaminomethyl)pyrrolidin-2-one is sourced from PubChem (CID 169259581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).