N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide

C18H26N2O6 — CID 126503651

IUPACN-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide
SMILESC#Cc1ccc(NC(=O)COCCOCCOCCOCCOC)nc1
InChIInChI=1S/C18H26N2O6/c1-3-16-4-5-17(19-14-16)20-18(21)15-26-13-12-25-11-10-24-9-8-23-7-6-22-2/h1,4-5,14H,6-13,15H2,2H3,(H,19,20,21)
InChIKeyPUQAZSGLAXCTQU-UHFFFAOYSA-N
MW366.41 g/mol
LogP0.71
Rot. Bonds15

About N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide

N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide (PubChem CID 126503651) has the molecular formula C18H26N2O6 and a molecular weight of 366.41 g/mol. Its IUPAC name is N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide.

Molecular Properties

Compound NameN-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide
PubChem CID126503651
Molecular FormulaC18H26N2O6
Molecular Weight366.41 g/mol
Exact Mass366.18
IUPAC NameN-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide
SMILESC#Cc1ccc(NC(=O)COCCOCCOCCOCCOC)nc1
InChIInChI=1S/C18H26N2O6/c1-3-16-4-5-17(19-14-16)20-18(21)15-26-13-12-25-11-10-24-9-8-23-7-6-22-2/h1,4-5,14H,6-13,15H2,2H3,(H,19,20,21)
InChIKeyPUQAZSGLAXCTQU-UHFFFAOYSA-N
XLogP0.71
TPSA88.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.41
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethoxy)-N-(1,2-oxazol-3-yl)acetamide
CID 103895196
N-(6-bromo-3-pyridinyl)-2-(2-methoxyethoxy)acetamide
CID 103789411
3-methoxy-N-(5-methyl-2-pyridinyl)propanamide
CID 127118084
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-methoxyethoxy)acetamide
CID 104619698
N-(6-ethynyl-3-pyridinyl)-4-[2-(2-methoxyethoxy)ethoxy]butanamide
CID 147160524
N-(5-bromo-2-pyridinyl)-2-ethoxyacetamide
CID 60655115
N-(2-bromo-3-pyridinyl)-2-(2-methoxyethoxy)acetamide
CID 103819290
2-(2-methoxyethoxy)-N-(1-propan-2-ylpyrazol-3-yl)acetamide
CID 114115113
2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629929
ethyl 2-[[2-(2-methoxyethoxy)acetyl]amino]pyridine-4-carboxylate
CID 108731992
2-methoxy-N-pyrimidin-4-ylacetamide
CID 110460486
N-[5-[2-(2-methoxyethoxy)ethyl-methylamino]-2-pyridinyl]azetidine-3-carboxamide
CID 146314129

Frequently Asked Questions

What is the IUPAC name of N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide?
The IUPAC name of N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide (CID 126503651) is N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide.
What is the SMILES notation for N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide?
The canonical SMILES for N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide is C#Cc1ccc(NC(=O)COCCOCCOCCOCCOC)nc1.
What is the InChIKey of N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide?
The InChIKey is PUQAZSGLAXCTQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O6/c1-3-16-4-5-17(19-14-16)20-18(21)15-26-13-12-25-11-10-24-9-8-23-7-6-22-2/h1,4-5,14H,6-13,15H2,2H3,(H,19,20,21).
What are the key properties of N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide?
N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide has a molecular weight of 366.41 g/mol, XLogP of 0.71, 15 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethynyl-2-pyridinyl)-2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetamide is sourced from PubChem (CID 126503651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).