(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide

C8H15N3O3 — CID 25391090

IUPAC(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide
SMILESCOCC(=O)N1CCN[C@@H](C(N)=O)C1
InChIInChI=1S/C8H15N3O3/c1-14-5-7(12)11-3-2-10-6(4-11)8(9)13/h6,10H,2-5H2,1H3,(H2,9,13)/t6-/m1/s1
InChIKeyIAKKTUIXFWBSGP-ZCFIWIBFSA-N
MW201.23 g/mol
LogP-2.08
Rot. Bonds3

About (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide

(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide (PubChem CID 25391090) has the molecular formula C8H15N3O3 and a molecular weight of 201.23 g/mol. Its IUPAC name is (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide
PubChem CID25391090
Molecular FormulaC8H15N3O3
Molecular Weight201.23 g/mol
Exact Mass201.11
IUPAC Name(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide
SMILESCOCC(=O)N1CCN[C@@H](C(N)=O)C1
InChIInChI=1S/C8H15N3O3/c1-14-5-7(12)11-3-2-10-6(4-11)8(9)13/h6,10H,2-5H2,1H3,(H2,9,13)/t6-/m1/s1
InChIKeyIAKKTUIXFWBSGP-ZCFIWIBFSA-N
XLogP-2.08
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 5-2.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide?
The IUPAC name of (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide (CID 25391090) is (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide.
What is the SMILES notation for (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide?
The canonical SMILES for (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide is COCC(=O)N1CCN[C@@H](C(N)=O)C1.
What is the InChIKey of (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide?
The InChIKey is IAKKTUIXFWBSGP-ZCFIWIBFSA-N. The full InChI is InChI=1S/C8H15N3O3/c1-14-5-7(12)11-3-2-10-6(4-11)8(9)13/h6,10H,2-5H2,1H3,(H2,9,13)/t6-/m1/s1.
What are the key properties of (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide?
(2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide has a molecular weight of 201.23 g/mol, XLogP of -2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(2-methoxyacetyl)piperazine-2-carboxamide is sourced from PubChem (CID 25391090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).