N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide

C11H20N4O2 — CID 80689226

IUPACN-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide
SMILESCOCCNC(=O)CNCCc1cnn(C)c1
InChIInChI=1S/C11H20N4O2/c1-15-9-10(7-14-15)3-4-12-8-11(16)13-5-6-17-2/h7,9,12H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyWEXNRSYJDDIMPF-UHFFFAOYSA-N
MW240.31 g/mol
LogP-0.69
Rot. Bonds8

About N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide

N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide (PubChem CID 80689226) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide
PubChem CID80689226
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC NameN-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide
SMILESCOCCNC(=O)CNCCc1cnn(C)c1
InChIInChI=1S/C11H20N4O2/c1-15-9-10(7-14-15)3-4-12-8-11(16)13-5-6-17-2/h7,9,12H,3-6,8H2,1-2H3,(H,13,16)
InChIKeyWEXNRSYJDDIMPF-UHFFFAOYSA-N
XLogP-0.69
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-0.69
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

N-[2-(1-methylpyrazol-4-yl)ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78924536
N-cyclopropyl-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide
CID 80688588
2-(2-methoxyethylamino)-N-[2-(1-phenylpyrazol-4-yl)ethyl]acetamide;hydrochloride
CID 119700611
N-[2-(1-methylpyrazol-4-yl)ethyl]-2-(4-sulfanylphenyl)acetamide
CID 107032863
N-(2-methoxyethyl)-1-methylpyrazole-4-carboxamide
CID 19474676
4-methoxy-2-methyl-1-[2-(1-methylpyrazol-4-yl)ethylamino]butan-2-ol
CID 106255495
N-(3-methoxypropyl)-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetamide
CID 51183315
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-oxopentanamide
CID 80682207
3-(methylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]propanamide
CID 80682637
4-hydroxy-N-[2-(1-methylpyrazol-4-yl)ethyl]butanamide
CID 80686901
2-methoxy-N-[(1-methylpyrazol-4-yl)methyl]ethanamine;hydrochloride
CID 126966602
2-(2-hydroxyphenyl)-N-[2-(1-methylpyrazol-4-yl)ethyl]acetamide
CID 78990918

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide (CID 80689226) is N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide is COCCNC(=O)CNCCc1cnn(C)c1.
What is the InChIKey of N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide?
The InChIKey is WEXNRSYJDDIMPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-15-9-10(7-14-15)3-4-12-8-11(16)13-5-6-17-2/h7,9,12H,3-6,8H2,1-2H3,(H,13,16).
What are the key properties of N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide?
N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide has a molecular weight of 240.31 g/mol, XLogP of -0.69, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[2-(1-methylpyrazol-4-yl)ethylamino]acetamide is sourced from PubChem (CID 80689226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).