N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide

C14H26N4O3 — CID 63876904

IUPACN-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C(=O)COC2CCNCC2)CC1
InChIInChI=1S/C14H26N4O3/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-21-12-3-5-15-6-4-12/h12,15H,2-11H2,1H3,(H,16,20)
InChIKeyGSEFXNNAFMCWLN-UHFFFAOYSA-N
MW298.39 g/mol
LogP-0.37
Rot. Bonds4

About N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide

N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide (PubChem CID 63876904) has the molecular formula C14H26N4O3 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide
PubChem CID63876904
Molecular FormulaC14H26N4O3
Molecular Weight298.39 g/mol
Exact Mass298.20
IUPAC NameN-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C(=O)COC2CCNCC2)CC1
InChIInChI=1S/C14H26N4O3/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-21-12-3-5-15-6-4-12/h12,15H,2-11H2,1H3,(H,16,20)
InChIKeyGSEFXNNAFMCWLN-UHFFFAOYSA-N
XLogP-0.37
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide?
The IUPAC name of N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide (CID 63876904) is N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide.
What is the SMILES notation for N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide?
The canonical SMILES for N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide is CCNC(=O)N1CCN(C(=O)COC2CCNCC2)CC1.
What is the InChIKey of N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide?
The InChIKey is GSEFXNNAFMCWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-21-12-3-5-15-6-4-12/h12,15H,2-11H2,1H3,(H,16,20).
What are the key properties of N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide?
N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide has a molecular weight of 298.39 g/mol, XLogP of -0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-piperidin-4-yloxyacetyl)piperazine-1-carboxamide is sourced from PubChem (CID 63876904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).