ethyl 2-(1-carbamoylpiperidin-4-yl)acetate

C10H18N2O3 — CID 18722730

IUPACethyl 2-(1-carbamoylpiperidin-4-yl)acetate
SMILESCCOC(=O)CC1CCN(C(N)=O)CC1
InChIInChI=1S/C10H18N2O3/c1-2-15-9(13)7-8-3-5-12(6-4-8)10(11)14/h8H,2-7H2,1H3,(H2,11,14)
InChIKeyXCWCWYPDHUQBMP-UHFFFAOYSA-N
MW214.26 g/mol
LogP0.73
Rot. Bonds3

About ethyl 2-(1-carbamoylpiperidin-4-yl)acetate

ethyl 2-(1-carbamoylpiperidin-4-yl)acetate (PubChem CID 18722730) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is ethyl 2-(1-carbamoylpiperidin-4-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(1-carbamoylpiperidin-4-yl)acetate
PubChem CID18722730
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Nameethyl 2-(1-carbamoylpiperidin-4-yl)acetate
SMILESCCOC(=O)CC1CCN(C(N)=O)CC1
InChIInChI=1S/C10H18N2O3/c1-2-15-9(13)7-8-3-5-12(6-4-8)10(11)14/h8H,2-7H2,1H3,(H2,11,14)
InChIKeyXCWCWYPDHUQBMP-UHFFFAOYSA-N
XLogP0.73
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(1-carbamoylpiperidin-4-yl)acetate?
The IUPAC name of ethyl 2-(1-carbamoylpiperidin-4-yl)acetate (CID 18722730) is ethyl 2-(1-carbamoylpiperidin-4-yl)acetate.
What is the SMILES notation for ethyl 2-(1-carbamoylpiperidin-4-yl)acetate?
The canonical SMILES for ethyl 2-(1-carbamoylpiperidin-4-yl)acetate is CCOC(=O)CC1CCN(C(N)=O)CC1.
What is the InChIKey of ethyl 2-(1-carbamoylpiperidin-4-yl)acetate?
The InChIKey is XCWCWYPDHUQBMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-2-15-9(13)7-8-3-5-12(6-4-8)10(11)14/h8H,2-7H2,1H3,(H2,11,14).
What are the key properties of ethyl 2-(1-carbamoylpiperidin-4-yl)acetate?
ethyl 2-(1-carbamoylpiperidin-4-yl)acetate has a molecular weight of 214.26 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(1-carbamoylpiperidin-4-yl)acetate is sourced from PubChem (CID 18722730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).