N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride

C9H18ClN3O3 — CID 119669590

IUPACN-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride
SMILESCOCCNC(=O)CN1CCNCC1=O.Cl
InChIInChI=1S/C9H17N3O3.ClH/c1-15-5-3-11-8(13)7-12-4-2-10-6-9(12)14;/h10H,2-7H2,1H3,(H,11,13);1H
InChIKeyGASUVQVOQOPWHK-UHFFFAOYSA-N
MW251.71 g/mol
LogP-1.40
Rot. Bonds5

About N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride

N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride (PubChem CID 119669590) has the molecular formula C9H18ClN3O3 and a molecular weight of 251.71 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride
PubChem CID119669590
Molecular FormulaC9H18ClN3O3
Molecular Weight251.71 g/mol
Exact Mass251.10
IUPAC NameN-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride
SMILESCOCCNC(=O)CN1CCNCC1=O.Cl
InChIInChI=1S/C9H17N3O3.ClH/c1-15-5-3-11-8(13)7-12-4-2-10-6-9(12)14;/h10H,2-7H2,1H3,(H,11,13);1H
InChIKeyGASUVQVOQOPWHK-UHFFFAOYSA-N
XLogP-1.40
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.71
LogP ≤ 5-1.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 62310212
methyl 2-(2-oxopiperazin-1-yl)acetate;hydrochloride
CID 54759045
N-(2-methoxyethyl)-2-(3-methyl-2-oxopiperazin-1-yl)acetamide
CID 63600201
2-(2-oxopiperazin-1-yl)-N-propan-2-ylacetamide
CID 62311797
N-(2-methoxyethyl)-2-(3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-4-yl)acetamide
CID 69348838
N-ethyl-2-(2-oxo-1,4-diazepan-1-yl)acetamide
CID 65362324
N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide
CID 78874251
N-(2-methylcyclopropyl)-2-(2-oxopiperazin-1-yl)acetamide
CID 119732239
N-(3-methoxypropyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 94869868
1-[3-(2-methoxyethoxy)propyl]piperazin-2-one
CID 103412181
N-(2-methoxyethyl)-2-(2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-1-yl)acetamide
CID 65361308
2-(2-oxopiperazin-1-yl)-N-[(3R)-4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]acetamide
CID 124699445

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride?
The IUPAC name of N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride (CID 119669590) is N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride.
What is the SMILES notation for N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride?
The canonical SMILES for N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride is COCCNC(=O)CN1CCNCC1=O.Cl.
What is the InChIKey of N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride?
The InChIKey is GASUVQVOQOPWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3.ClH/c1-15-5-3-11-8(13)7-12-4-2-10-6-9(12)14;/h10H,2-7H2,1H3,(H,11,13);1H.
What are the key properties of N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride?
N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride has a molecular weight of 251.71 g/mol, XLogP of -1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(2-oxopiperazin-1-yl)acetamide;hydrochloride is sourced from PubChem (CID 119669590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).