N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide

C10H21N3O2 — CID 167088370

IUPACN-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide
SMILESCOCCNC(=O)N1CCN(C)C(C)C1
InChIInChI=1S/C10H21N3O2/c1-9-8-13(6-5-12(9)2)10(14)11-4-7-15-3/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyPXNLXLIVVPOKKO-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.02
Rot. Bonds3

About N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide

N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide (PubChem CID 167088370) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide
PubChem CID167088370
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide
SMILESCOCCNC(=O)N1CCN(C)C(C)C1
InChIInChI=1S/C10H21N3O2/c1-9-8-13(6-5-12(9)2)10(14)11-4-7-15-3/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyPXNLXLIVVPOKKO-UHFFFAOYSA-N
XLogP-0.02
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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N-(2-methoxyethyl)-4-[1-oxo-1-(propan-2-ylamino)propan-2-yl]piperazine-1-carboxamide
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3-Cyclopropyl-1-[2-(dimethylamino)ethyl]-1-(2-methoxyethyl)urea
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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide (CID 167088370) is N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide is COCCNC(=O)N1CCN(C)C(C)C1.
What is the InChIKey of N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide?
The InChIKey is PXNLXLIVVPOKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-9-8-13(6-5-12(9)2)10(14)11-4-7-15-3/h9H,4-8H2,1-3H3,(H,11,14).
What are the key properties of N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide?
N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide has a molecular weight of 215.30 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3,4-dimethylpiperazine-1-carboxamide is sourced from PubChem (CID 167088370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).