N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide

C11H20N4O3 — CID 114255770

IUPACN-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide
SMILESCOCCNC(=O)CNCc1cc(OC)n(C)n1
InChIInChI=1S/C11H20N4O3/c1-15-11(18-3)6-9(14-15)7-12-8-10(16)13-4-5-17-2/h6,12H,4-5,7-8H2,1-3H3,(H,13,16)
InChIKeyQIZFMBXGWBSVGK-UHFFFAOYSA-N
MW256.31 g/mol
LogP-0.72
Rot. Bonds8

About N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide

N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide (PubChem CID 114255770) has the molecular formula C11H20N4O3 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide
PubChem CID114255770
Molecular FormulaC11H20N4O3
Molecular Weight256.31 g/mol
Exact Mass256.15
IUPAC NameN-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide
SMILESCOCCNC(=O)CNCc1cc(OC)n(C)n1
InChIInChI=1S/C11H20N4O3/c1-15-11(18-3)6-9(14-15)7-12-8-10(16)13-4-5-17-2/h6,12H,4-5,7-8H2,1-3H3,(H,13,16)
InChIKeyQIZFMBXGWBSVGK-UHFFFAOYSA-N
XLogP-0.72
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide (CID 114255770) is N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide is COCCNC(=O)CNCc1cc(OC)n(C)n1.
What is the InChIKey of N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide?
The InChIKey is QIZFMBXGWBSVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3/c1-15-11(18-3)6-9(14-15)7-12-8-10(16)13-4-5-17-2/h6,12H,4-5,7-8H2,1-3H3,(H,13,16).
What are the key properties of N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide?
N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide has a molecular weight of 256.31 g/mol, XLogP of -0.72, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]acetamide is sourced from PubChem (CID 114255770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).