2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride

C11H21ClN4O2 — CID 119709927

IUPAC2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCCn1cccn1.Cl
InChIInChI=1S/C11H20N4O2.ClH/c1-17-9-6-12-10-11(16)13-4-2-7-15-8-3-5-14-15;/h3,5,8,12H,2,4,6-7,9-10H2,1H3,(H,13,16);1H
InChIKeyVEBNYRYARUQJSW-UHFFFAOYSA-N
MW276.77 g/mol
LogP0.05
Rot. Bonds9

About 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride

2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride (PubChem CID 119709927) has the molecular formula C11H21ClN4O2 and a molecular weight of 276.77 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride
PubChem CID119709927
Molecular FormulaC11H21ClN4O2
Molecular Weight276.77 g/mol
Exact Mass276.14
IUPAC Name2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCCn1cccn1.Cl
InChIInChI=1S/C11H20N4O2.ClH/c1-17-9-6-12-10-11(16)13-4-2-7-15-8-3-5-14-15;/h3,5,8,12H,2,4,6-7,9-10H2,1H3,(H,13,16);1H
InChIKeyVEBNYRYARUQJSW-UHFFFAOYSA-N
XLogP0.05
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(tert-butylamino)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 112685077
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
3-methyl-N-(3-pyrazol-1-ylpropyl)butanamide
CID 51077805
2-(cyclopropylamino)-N-(3-pyrazol-1-ylpropyl)acetamide
CID 115761179
4-amino-3-methoxy-N-(3-pyrazol-1-ylpropyl)butanamide
CID 103156610
N-(2-methoxyethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 61487655
4-amino-N-(3-pyrazol-1-ylpropyl)butanamide;hydrochloride
CID 119281865
4-(methylamino)-N-(3-pyrazol-1-ylpropyl)butanamide
CID 115738303
4-(4-methoxyphenoxy)-N-(3-pyrazol-1-ylpropyl)butanamide
CID 37394128
1-(5-methoxypentyl)-2-methyl-3-(3-pyrazol-1-ylpropyl)guanidine
CID 111905075
tert-butyl N-(3-pyrazol-1-ylpropyl)carbamate
CID 69176267
7-amino-N-(3-pyrazol-1-ylpropyl)heptanamide;hydrochloride
CID 119709906

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride (CID 119709927) is 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride is COCCNCC(=O)NCCCn1cccn1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride?
The InChIKey is VEBNYRYARUQJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2.ClH/c1-17-9-6-12-10-11(16)13-4-2-7-15-8-3-5-14-15;/h3,5,8,12H,2,4,6-7,9-10H2,1H3,(H,13,16);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride has a molecular weight of 276.77 g/mol, XLogP of 0.05, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(3-pyrazol-1-ylpropyl)acetamide;hydrochloride is sourced from PubChem (CID 119709927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).