5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one

C11H20N2O2 — CID 103829234

IUPAC5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one
SMILESO=C1CCC(CNC2(CO)CCCC2)N1
InChIInChI=1S/C11H20N2O2/c14-8-11(5-1-2-6-11)12-7-9-3-4-10(15)13-9/h9,12,14H,1-8H2,(H,13,15)
InChIKeyIGJAMWFJUXDEBK-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.16
Rot. Bonds4

About 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one

5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one (PubChem CID 103829234) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one
PubChem CID103829234
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one
SMILESO=C1CCC(CNC2(CO)CCCC2)N1
InChIInChI=1S/C11H20N2O2/c14-8-11(5-1-2-6-11)12-7-9-3-4-10(15)13-9/h9,12,14H,1-8H2,(H,13,15)
InChIKeyIGJAMWFJUXDEBK-UHFFFAOYSA-N
XLogP0.16
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one?
The IUPAC name of 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one (CID 103829234) is 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one.
What is the SMILES notation for 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one?
The canonical SMILES for 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one is O=C1CCC(CNC2(CO)CCCC2)N1.
What is the InChIKey of 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one?
The InChIKey is IGJAMWFJUXDEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-8-11(5-1-2-6-11)12-7-9-3-4-10(15)13-9/h9,12,14H,1-8H2,(H,13,15).
What are the key properties of 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one?
5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one has a molecular weight of 212.29 g/mol, XLogP of 0.16, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]pyrrolidin-2-one is sourced from PubChem (CID 103829234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).