N-(5-formyl-2-pyridinyl)acetamide

C8H8N2O2 — CID 22113222

IUPACN-(5-formyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(C=O)cn1
InChIInChI=1S/C8H8N2O2/c1-6(12)10-8-3-2-7(5-11)4-9-8/h2-5H,1H3,(H,9,10,12)
InChIKeyVVDNQGICIUVXTD-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.85
Rot. Bonds2

About N-(5-formyl-2-pyridinyl)acetamide

N-(5-formyl-2-pyridinyl)acetamide (PubChem CID 22113222) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is N-(5-formyl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(5-formyl-2-pyridinyl)acetamide
PubChem CID22113222
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC NameN-(5-formyl-2-pyridinyl)acetamide
SMILESCC(=O)Nc1ccc(C=O)cn1
InChIInChI=1S/C8H8N2O2/c1-6(12)10-8-3-2-7(5-11)4-9-8/h2-5H,1H3,(H,9,10,12)
InChIKeyVVDNQGICIUVXTD-UHFFFAOYSA-N
XLogP0.85
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(5-formyl-2-pyridinyl)acetamide?
The IUPAC name of N-(5-formyl-2-pyridinyl)acetamide (CID 22113222) is N-(5-formyl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(5-formyl-2-pyridinyl)acetamide?
The canonical SMILES for N-(5-formyl-2-pyridinyl)acetamide is CC(=O)Nc1ccc(C=O)cn1.
What is the InChIKey of N-(5-formyl-2-pyridinyl)acetamide?
The InChIKey is VVDNQGICIUVXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-6(12)10-8-3-2-7(5-11)4-9-8/h2-5H,1H3,(H,9,10,12).
What are the key properties of N-(5-formyl-2-pyridinyl)acetamide?
N-(5-formyl-2-pyridinyl)acetamide has a molecular weight of 164.16 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-formyl-2-pyridinyl)acetamide is sourced from PubChem (CID 22113222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).