N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide

C10H21N3O2 — CID 80549897

IUPACN-ethoxy-2-methyl-2-piperazin-1-ylpropanamide
SMILESCCONC(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C10H21N3O2/c1-4-15-12-9(14)10(2,3)13-7-5-11-6-8-13/h11H,4-8H2,1-3H3,(H,12,14)
InChIKeyVTTAIGLCABCFBZ-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.26
Rot. Bonds4

About N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide

N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide (PubChem CID 80549897) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-ethoxy-2-methyl-2-piperazin-1-ylpropanamide
PubChem CID80549897
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN-ethoxy-2-methyl-2-piperazin-1-ylpropanamide
SMILESCCONC(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C10H21N3O2/c1-4-15-12-9(14)10(2,3)13-7-5-11-6-8-13/h11H,4-8H2,1-3H3,(H,12,14)
InChIKeyVTTAIGLCABCFBZ-UHFFFAOYSA-N
XLogP-0.26
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548345
N-(2-ethoxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80548764
2-methyl-2-piperazin-1-yl-N-propylpropanamide
CID 80548473
N-butan-2-yl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548261
N-butyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548594
(2S,3S)-3-methyl-2-[(2-methyl-2-piperazin-1-ylpropanoyl)amino]pentanoic acid
CID 80548885
N-(3-aminopropyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80548800
2-methyl-N-methylsulfonyl-2-piperazin-1-ylpropanamide
CID 103287498
2-methyl-2-piperazin-1-yl-N-prop-2-ynylpropanamide
CID 80548330
ethyl 2-methyl-2-piperazin-1-ylbutanoate
CID 61001895
N-hexyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548728
N-(1-methoxypropan-2-yl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80548456

Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide (CID 80549897) is N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide is CCONC(=O)C(C)(C)N1CCNCC1.
What is the InChIKey of N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide?
The InChIKey is VTTAIGLCABCFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-4-15-12-9(14)10(2,3)13-7-5-11-6-8-13/h11H,4-8H2,1-3H3,(H,12,14).
What are the key properties of N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide?
N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide has a molecular weight of 215.30 g/mol, XLogP of -0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-methyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 80549897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).