methyl 2-(4-cyclopentylmorpholin-2-yl)acetate

C12H21NO3 — CID 115537752

IUPACmethyl 2-(4-cyclopentylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(C2CCCC2)CCO1
InChIInChI=1S/C12H21NO3/c1-15-12(14)8-11-9-13(6-7-16-11)10-4-2-3-5-10/h10-11H,2-9H2,1H3
InChIKeyGGLPGQGRSIQFIY-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.19
Rot. Bonds3

About methyl 2-(4-cyclopentylmorpholin-2-yl)acetate

methyl 2-(4-cyclopentylmorpholin-2-yl)acetate (PubChem CID 115537752) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is methyl 2-(4-cyclopentylmorpholin-2-yl)acetate.

Molecular Properties

Compound Namemethyl 2-(4-cyclopentylmorpholin-2-yl)acetate
PubChem CID115537752
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Namemethyl 2-(4-cyclopentylmorpholin-2-yl)acetate
SMILESCOC(=O)CC1CN(C2CCCC2)CCO1
InChIInChI=1S/C12H21NO3/c1-15-12(14)8-11-9-13(6-7-16-11)10-4-2-3-5-10/h10-11H,2-9H2,1H3
InChIKeyGGLPGQGRSIQFIY-UHFFFAOYSA-N
XLogP1.19
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[4-(3-ethylcyclohexyl)morpholin-2-yl]acetate
CID 115537746
2-(4-cyclohexylmorpholin-2-yl)acetic acid
CID 66433671
methyl 2-[(2R)-4-[(1R)-cyclohex-2-en-1-yl]morpholin-2-yl]acetate
CID 96999144
(4-cyclopentylmorpholin-2-yl)methanol
CID 45098591
(4-cyclohexylmorpholin-2-yl)methanol
CID 83831638
methyl 2-[4-(cyclobutanecarbonyl)morpholin-2-yl]acetate
CID 79806815
2-[4-(oxan-3-yl)morpholin-2-yl]acetic acid
CID 66432953
methyl 2-[4-[1-(cyclopentylamino)-1-oxopropan-2-yl]morpholin-2-yl]acetate
CID 79827501
1-cyclopropyl-N-[[(2S)-4-cyclopropylmorpholin-2-yl]methyl]methanamine
CID 95979352
methyl 2-[4-(2-morpholin-4-ylethyl)morpholin-2-yl]acetate
CID 79822697
2-(bromomethyl)-4-cyclohexylmorpholine
CID 82937177
2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid
CID 66434708

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4-cyclopentylmorpholin-2-yl)acetate?
The IUPAC name of methyl 2-(4-cyclopentylmorpholin-2-yl)acetate (CID 115537752) is methyl 2-(4-cyclopentylmorpholin-2-yl)acetate.
What is the SMILES notation for methyl 2-(4-cyclopentylmorpholin-2-yl)acetate?
The canonical SMILES for methyl 2-(4-cyclopentylmorpholin-2-yl)acetate is COC(=O)CC1CN(C2CCCC2)CCO1.
What is the InChIKey of methyl 2-(4-cyclopentylmorpholin-2-yl)acetate?
The InChIKey is GGLPGQGRSIQFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c1-15-12(14)8-11-9-13(6-7-16-11)10-4-2-3-5-10/h10-11H,2-9H2,1H3.
What are the key properties of methyl 2-(4-cyclopentylmorpholin-2-yl)acetate?
methyl 2-(4-cyclopentylmorpholin-2-yl)acetate has a molecular weight of 227.30 g/mol, XLogP of 1.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(4-cyclopentylmorpholin-2-yl)acetate is sourced from PubChem (CID 115537752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).