[1-(ethylcarbamoyl)piperidin-4-yl] acetate

C10H18N2O3 — CID 53016482

IUPAC[1-(ethylcarbamoyl)piperidin-4-yl] acetate
SMILESCCNC(=O)N1CCC(OC(C)=O)CC1
InChIInChI=1S/C10H18N2O3/c1-3-11-10(14)12-6-4-9(5-7-12)15-8(2)13/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyGNBDSBMWGLUZJM-UHFFFAOYSA-N
MW214.26 g/mol
LogP0.74
Rot. Bonds2

About [1-(ethylcarbamoyl)piperidin-4-yl] acetate

[1-(ethylcarbamoyl)piperidin-4-yl] acetate (PubChem CID 53016482) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is [1-(ethylcarbamoyl)piperidin-4-yl] acetate.

Molecular Properties

Compound Name[1-(ethylcarbamoyl)piperidin-4-yl] acetate
PubChem CID53016482
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name[1-(ethylcarbamoyl)piperidin-4-yl] acetate
SMILESCCNC(=O)N1CCC(OC(C)=O)CC1
InChIInChI=1S/C10H18N2O3/c1-3-11-10(14)12-6-4-9(5-7-12)15-8(2)13/h9H,3-7H2,1-2H3,(H,11,14)
InChIKeyGNBDSBMWGLUZJM-UHFFFAOYSA-N
XLogP0.74
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(ethylcarbamoyl)piperidin-4-yl] acetate?
The IUPAC name of [1-(ethylcarbamoyl)piperidin-4-yl] acetate (CID 53016482) is [1-(ethylcarbamoyl)piperidin-4-yl] acetate.
What is the SMILES notation for [1-(ethylcarbamoyl)piperidin-4-yl] acetate?
The canonical SMILES for [1-(ethylcarbamoyl)piperidin-4-yl] acetate is CCNC(=O)N1CCC(OC(C)=O)CC1.
What is the InChIKey of [1-(ethylcarbamoyl)piperidin-4-yl] acetate?
The InChIKey is GNBDSBMWGLUZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-3-11-10(14)12-6-4-9(5-7-12)15-8(2)13/h9H,3-7H2,1-2H3,(H,11,14).
What are the key properties of [1-(ethylcarbamoyl)piperidin-4-yl] acetate?
[1-(ethylcarbamoyl)piperidin-4-yl] acetate has a molecular weight of 214.26 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethylcarbamoyl)piperidin-4-yl] acetate is sourced from PubChem (CID 53016482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).