3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one

C12H23N3O2 — CID 79071630

IUPAC3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
SMILESCCNC1CCN(CC2CN(C)CCO2)C1=O
InChIInChI=1S/C12H23N3O2/c1-3-13-11-4-5-15(12(11)16)9-10-8-14(2)6-7-17-10/h10-11,13H,3-9H2,1-2H3
InChIKeyJHPHXDFTDRMITD-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.47
Rot. Bonds4

About 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one

3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one (PubChem CID 79071630) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
PubChem CID79071630
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
SMILESCCNC1CCN(CC2CN(C)CCO2)C1=O
InChIInChI=1S/C12H23N3O2/c1-3-13-11-4-5-15(12(11)16)9-10-8-14(2)6-7-17-10/h10-11,13H,3-9H2,1-2H3
InChIKeyJHPHXDFTDRMITD-UHFFFAOYSA-N
XLogP-0.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
CID 79078126
N-ethyl-8-[(4-methylmorpholin-2-yl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 79071084
3-cyclopropyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
CID 79077020
4-hydroxy-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 79071600
1-[(4-methylmorpholin-2-yl)methyl]-1,3-diazinane-2,4-dione
CID 79777308
3-(ethylamino)-1-[(3-hydroxycyclohexyl)methyl]pyrrolidin-2-one
CID 114148602
5-methyl-1-[(4-methylmorpholin-2-yl)methyl]-1,3-diazinane-2,4-dione
CID 79777205
3-(ethylamino)-1-(3-propoxypropyl)pyrrolidin-2-one
CID 82943080
3-ethyl-1-[(4-methylmorpholin-2-yl)methyl]-6-propan-2-ylpiperazine-2,5-dione
CID 79071601
3-(ethylamino)-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidin-2-one
CID 106418226
3-(ethylamino)-1-(2-thiomorpholin-4-ylethyl)pyrrolidin-2-one
CID 114173849
1-[(4-methylmorpholin-2-yl)methyl]-5-oxopyrrolidine-3-carbonitrile
CID 79071401

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The IUPAC name of 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one (CID 79071630) is 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one.
What is the SMILES notation for 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The canonical SMILES for 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one is CCNC1CCN(CC2CN(C)CCO2)C1=O.
What is the InChIKey of 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The InChIKey is JHPHXDFTDRMITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-3-13-11-4-5-15(12(11)16)9-10-8-14(2)6-7-17-10/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one?
3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one has a molecular weight of 241.33 g/mol, XLogP of -0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one is sourced from PubChem (CID 79071630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).