methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate

C13H22N2O4 — CID 66433180

IUPACmethyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)CC2CNCCO2)CC1
InChIInChI=1S/C13H22N2O4/c1-18-13(17)10-2-5-15(6-3-10)12(16)8-11-9-14-4-7-19-11/h10-11,14H,2-9H2,1H3
InChIKeyDAVZAAASLDRDQR-UHFFFAOYSA-N
MW270.33 g/mol
LogP-0.22
Rot. Bonds3

About methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate

methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate (PubChem CID 66433180) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate
PubChem CID66433180
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Namemethyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)CC2CNCCO2)CC1
InChIInChI=1S/C13H22N2O4/c1-18-13(17)10-2-5-15(6-3-10)12(16)8-11-9-14-4-7-19-11/h10-11,14H,2-9H2,1H3
InChIKeyDAVZAAASLDRDQR-UHFFFAOYSA-N
XLogP-0.22
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(2-morpholin-2-ylacetyl)piperidine-4-carboxamide
CID 66433581
1-(azepan-1-yl)-2-morpholin-2-ylethanone
CID 66433560
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-morpholin-2-ylethanone
CID 66428289
methyl 1-(2-piperidin-3-ylacetyl)piperidine-4-carboxylate
CID 62674333
methyl 1-[2-(azetidin-3-yl)acetyl]piperidine-4-carboxylate
CID 64617361
1-[(3S)-3-hydroxypyrrolidin-1-yl]-2-morpholin-2-ylethanone
CID 107217362
2-morpholin-2-yl-1-thiomorpholin-4-ylethanone
CID 66434733
1-(2-ethylmorpholin-4-yl)-2-morpholin-2-ylethanone
CID 66432993
1-[3-(diethylamino)pyrrolidin-1-yl]-2-morpholin-2-ylethanone
CID 66428750
1-(4-methylsulfonylpiperazin-1-yl)-2-morpholin-2-ylethanone;hydrochloride
CID 119696186
1-(4-hydroxy-4-methylazepan-1-yl)-2-morpholin-2-ylethanone
CID 107404309
1-[4-(2-chlorophenoxy)piperidin-1-yl]-2-morpholin-2-ylethanone
CID 70786895

Frequently Asked Questions

What is the IUPAC name of methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate?
The IUPAC name of methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate (CID 66433180) is methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate.
What is the SMILES notation for methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate?
The canonical SMILES for methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate is COC(=O)C1CCN(C(=O)CC2CNCCO2)CC1.
What is the InChIKey of methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate?
The InChIKey is DAVZAAASLDRDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c1-18-13(17)10-2-5-15(6-3-10)12(16)8-11-9-14-4-7-19-11/h10-11,14H,2-9H2,1H3.
What are the key properties of methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate?
methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate has a molecular weight of 270.33 g/mol, XLogP of -0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate is sourced from PubChem (CID 66433180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).