4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one

C11H21N3O2 — CID 114401064

IUPAC4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
SMILESCCN1CCOC(CN2CC(N)CC2=O)C1
InChIInChI=1S/C11H21N3O2/c1-2-13-3-4-16-10(7-13)8-14-6-9(12)5-11(14)15/h9-10H,2-8,12H2,1H3
InChIKeyYCMCKIPJYDGTCU-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.73
Rot. Bonds3

About 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one

4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one (PubChem CID 114401064) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
PubChem CID114401064
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one
SMILESCCN1CCOC(CN2CC(N)CC2=O)C1
InChIInChI=1S/C11H21N3O2/c1-2-13-3-4-16-10(7-13)8-14-6-9(12)5-11(14)15/h9-10H,2-8,12H2,1H3
InChIKeyYCMCKIPJYDGTCU-UHFFFAOYSA-N
XLogP-0.73
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-ethylmorpholin-2-yl)methyl]-3,4-dihydro-2H-quinolin-3-amine
CID 79182791
(4R)-4-amino-1-[[(2R)-oxolan-2-yl]methyl]pyrrolidin-2-one
CID 28815490
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-2,5-dione
CID 114400408
4-hydroxy-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 79071600
1-[(4-methylmorpholin-2-yl)methyl]-5-oxopyrrolidine-3-carbonitrile
CID 79071401
2,4-diethylmorpholine
CID 58988021
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
CID 79165951
3-ethyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-4-amine
CID 81460895
1-[(4-ethylmorpholin-2-yl)methyl]piperidin-2-imine
CID 114400417
1-[(4-ethylmorpholin-2-yl)methyl]pyrimidin-2-one
CID 116618394
4-ethyl-2-propylmorpholine
CID 127673597
2-(4-ethylmorpholin-2-yl)acetonitrile
CID 79164435

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The IUPAC name of 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one (CID 114401064) is 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one.
What is the SMILES notation for 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The canonical SMILES for 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one is CCN1CCOC(CN2CC(N)CC2=O)C1.
What is the InChIKey of 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one?
The InChIKey is YCMCKIPJYDGTCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-2-13-3-4-16-10(7-13)8-14-6-9(12)5-11(14)15/h9-10H,2-8,12H2,1H3.
What are the key properties of 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one?
4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one has a molecular weight of 227.31 g/mol, XLogP of -0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-2-one is sourced from PubChem (CID 114401064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).