1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one

C10H20N2O2 — CID 70877760

IUPAC1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one
SMILESCC1CCC(=O)N1CCN(C)CCO
InChIInChI=1S/C10H20N2O2/c1-9-3-4-10(14)12(9)6-5-11(2)7-8-13/h9,13H,3-8H2,1-2H3
InChIKeyPNIGNYBDTCDGPC-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.08
Rot. Bonds5

About 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one

1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one (PubChem CID 70877760) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one
PubChem CID70877760
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one
SMILESCC1CCC(=O)N1CCN(C)CCO
InChIInChI=1S/C10H20N2O2/c1-9-3-4-10(14)12(9)6-5-11(2)7-8-13/h9,13H,3-8H2,1-2H3
InChIKeyPNIGNYBDTCDGPC-UHFFFAOYSA-N
XLogP-0.08
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one?
The IUPAC name of 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one (CID 70877760) is 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one.
What is the SMILES notation for 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one?
The canonical SMILES for 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one is CC1CCC(=O)N1CCN(C)CCO.
What is the InChIKey of 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one?
The InChIKey is PNIGNYBDTCDGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9-3-4-10(14)12(9)6-5-11(2)7-8-13/h9,13H,3-8H2,1-2H3.
What are the key properties of 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one?
1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one has a molecular weight of 200.28 g/mol, XLogP of -0.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-hydroxyethyl(methyl)amino]ethyl]-5-methylpyrrolidin-2-one is sourced from PubChem (CID 70877760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).