2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid

C14H24N2O5 — CID 106588033

IUPAC2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid
SMILESCOCC1CCCN(C(=O)N2CCOCC2CC(=O)O)C1
InChIInChI=1S/C14H24N2O5/c1-20-9-11-3-2-4-15(8-11)14(19)16-5-6-21-10-12(16)7-13(17)18/h11-12H,2-10H2,1H3,(H,17,18)
InChIKeyDOSJQKZMOHALLC-UHFFFAOYSA-N
MW300.36 g/mol
LogP0.64
Rot. Bonds4

About 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid

2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid (PubChem CID 106588033) has the molecular formula C14H24N2O5 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid
PubChem CID106588033
Molecular FormulaC14H24N2O5
Molecular Weight300.36 g/mol
Exact Mass300.17
IUPAC Name2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid
SMILESCOCC1CCCN(C(=O)N2CCOCC2CC(=O)O)C1
InChIInChI=1S/C14H24N2O5/c1-20-9-11-3-2-4-15(8-11)14(19)16-5-6-21-10-12(16)7-13(17)18/h11-12H,2-10H2,1H3,(H,17,18)
InChIKeyDOSJQKZMOHALLC-UHFFFAOYSA-N
XLogP0.64
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholine-3-carboxylic acid
CID 106588001
2-[1-(3-methylmorpholine-4-carbonyl)piperidin-3-yl]acetic acid
CID 62691356
2-[4-(3-hydroxy-4-methylpiperidine-1-carbonyl)morpholin-3-yl]acetic acid
CID 102961872
2-[1-(3-ethylmorpholine-4-carbonyl)azetidin-3-yl]acetic acid
CID 64617831
2-[4-(3-methoxy-3-methylpiperidine-1-carbonyl)morpholin-3-yl]acetic acid
CID 107394034
(2R)-1-[3-(methoxymethyl)piperidine-1-carbonyl]pyrrolidine-2-carboxylic acid
CID 106588061
azepan-1-yl-[3-(methoxymethyl)piperidin-1-yl]methanone
CID 106586477
2-[1-(morpholine-4-carbonyl)pyrrolidin-2-yl]acetic acid
CID 61370369
2-[4-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)morpholin-3-yl]acetic acid
CID 114172612
3-[1-[3-(methoxymethyl)pyrrolidine-1-carbonyl]piperidin-2-yl]propanoic acid
CID 64597618
2-[4-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)morpholin-3-yl]acetic acid
CID 82753207
2-[4-[cyclobutylmethyl(ethyl)carbamoyl]morpholin-3-yl]acetic acid
CID 107400285

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid?
The IUPAC name of 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid (CID 106588033) is 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid.
What is the SMILES notation for 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid?
The canonical SMILES for 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid is COCC1CCCN(C(=O)N2CCOCC2CC(=O)O)C1.
What is the InChIKey of 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid?
The InChIKey is DOSJQKZMOHALLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O5/c1-20-9-11-3-2-4-15(8-11)14(19)16-5-6-21-10-12(16)7-13(17)18/h11-12H,2-10H2,1H3,(H,17,18).
What are the key properties of 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid?
2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid has a molecular weight of 300.36 g/mol, XLogP of 0.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(methoxymethyl)piperidine-1-carbonyl]morpholin-3-yl]acetic acid is sourced from PubChem (CID 106588033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).