4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one

C10H18N2O2 — CID 130899240

IUPAC4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one
SMILESCC1OCCC1NCC1CNC(=O)C1
InChIInChI=1S/C10H18N2O2/c1-7-9(2-3-14-7)11-5-8-4-10(13)12-6-8/h7-9,11H,2-6H2,1H3,(H,12,13)
InChIKeySECUTDOGCVQKGK-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.11
Rot. Bonds3

About 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one

4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one (PubChem CID 130899240) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one
PubChem CID130899240
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one
SMILESCC1OCCC1NCC1CNC(=O)C1
InChIInChI=1S/C10H18N2O2/c1-7-9(2-3-14-7)11-5-8-4-10(13)12-6-8/h7-9,11H,2-6H2,1H3,(H,12,13)
InChIKeySECUTDOGCVQKGK-UHFFFAOYSA-N
XLogP-0.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one?
The IUPAC name of 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one (CID 130899240) is 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one.
What is the SMILES notation for 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one?
The canonical SMILES for 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one is CC1OCCC1NCC1CNC(=O)C1.
What is the InChIKey of 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one?
The InChIKey is SECUTDOGCVQKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7-9(2-3-14-7)11-5-8-4-10(13)12-6-8/h7-9,11H,2-6H2,1H3,(H,12,13).
What are the key properties of 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one?
4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one has a molecular weight of 198.27 g/mol, XLogP of -0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2-methyloxolan-3-yl)amino]methyl]pyrrolidin-2-one is sourced from PubChem (CID 130899240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).