methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate

C11H20N2O3 — CID 61010980

IUPACmethyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate
SMILESCCNC(=O)N1CCCCC1CC(=O)OC
InChIInChI=1S/C11H20N2O3/c1-3-12-11(15)13-7-5-4-6-9(13)8-10(14)16-2/h9H,3-8H2,1-2H3,(H,12,15)
InChIKeyNOUUUGCKYIUQON-UHFFFAOYSA-N
MW228.29 g/mol
LogP1.13
Rot. Bonds3

About methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate

methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate (PubChem CID 61010980) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate
PubChem CID61010980
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Namemethyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate
SMILESCCNC(=O)N1CCCCC1CC(=O)OC
InChIInChI=1S/C11H20N2O3/c1-3-12-11(15)13-7-5-4-6-9(13)8-10(14)16-2/h9H,3-8H2,1-2H3,(H,12,15)
InChIKeyNOUUUGCKYIUQON-UHFFFAOYSA-N
XLogP1.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[2-(2-methoxy-2-oxoethyl)piperidin-1-yl]-2-oxoacetate
CID 20713862
methyl 2-[1-(dimethylcarbamoyl)piperidin-2-yl]acetate
CID 79154755
N-ethyl-2-(pyrrolidin-1-ylmethyl)azepane-1-carboxamide
CID 110196370
4-[[2-(2-methoxy-2-oxoethyl)pyrrolidine-1-carbonyl]amino]butanoic acid
CID 122022100
methyl 2-[1-(2-aminobutanoyl)piperidin-2-yl]acetate
CID 54916660
ethyl 2-(2-methoxy-2-oxoethyl)pyrrolidine-1-carboxylate
CID 23251970
2-[1-[(2-methoxy-2-oxoethyl)carbamoyl]pyrrolidin-2-yl]acetic acid
CID 61371746
(2R)-N-ethyl-2-(methanesulfonamidomethyl)piperidine-1-carboxamide
CID 95160650
2-ethyl-N-(methoxymethyl)piperidine-1-carboxamide
CID 108893599
5-[2-(2-methoxy-2-oxoethyl)piperidin-1-yl]-5-oxopentanoic acid
CID 54916732
methyl 2-[1-(1-methylcyclohexanecarbonyl)piperidin-2-yl]acetate
CID 106828161
methyl 2-[1-(3-amino-2,2-dimethylpropanoyl)piperidin-2-yl]acetate
CID 115426493

Frequently Asked Questions

What is the IUPAC name of methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate?
The IUPAC name of methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate (CID 61010980) is methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate.
What is the SMILES notation for methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate?
The canonical SMILES for methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate is CCNC(=O)N1CCCCC1CC(=O)OC.
What is the InChIKey of methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate?
The InChIKey is NOUUUGCKYIUQON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-3-12-11(15)13-7-5-4-6-9(13)8-10(14)16-2/h9H,3-8H2,1-2H3,(H,12,15).
What are the key properties of methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate?
methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate has a molecular weight of 228.29 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[1-(ethylcarbamoyl)piperidin-2-yl]acetate is sourced from PubChem (CID 61010980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).