2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride

C14H19ClN4O2 — CID 119400016

IUPAC2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1-n1cccn1.Cl
InChIInChI=1S/C14H18N4O2.ClH/c1-20-10-8-15-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-16-18;/h2-7,9,15H,8,10-11H2,1H3,(H,17,19);1H
InChIKeyJAWMZOUKSYBCFH-UHFFFAOYSA-N
MW310.79 g/mol
LogP1.47
Rot. Bonds7

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

2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride (PubChem CID 119400016) has the molecular formula C14H19ClN4O2 and a molecular weight of 310.79 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride
PubChem CID119400016
Molecular FormulaC14H19ClN4O2
Molecular Weight310.79 g/mol
Exact Mass310.12
IUPAC Name2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1-n1cccn1.Cl
InChIInChI=1S/C14H18N4O2.ClH/c1-20-10-8-15-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-16-18;/h2-7,9,15H,8,10-11H2,1H3,(H,17,19);1H
InChIKeyJAWMZOUKSYBCFH-UHFFFAOYSA-N
XLogP1.47
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.79
LogP ≤ 51.47
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

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CID 60837811
2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
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2-[[2-(2-methoxyethylamino)acetyl]amino]-N-(2-methylpropyl)benzamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride (CID 119400016) is 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride is COCCNCC(=O)Nc1ccccc1-n1cccn1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride?
The InChIKey is JAWMZOUKSYBCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2.ClH/c1-20-10-8-15-11-14(19)17-12-5-2-3-6-13(12)18-9-4-7-16-18;/h2-7,9,15H,8,10-11H2,1H3,(H,17,19);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride has a molecular weight of 310.79 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(2-pyrazol-1-ylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 119400016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).