N-(2-formyl-3-pyridinyl)acetamide

C8H8N2O2 — CID 54486982

IUPACN-(2-formyl-3-pyridinyl)acetamide
SMILESCC(=O)Nc1cccnc1C=O
InChIInChI=1S/C8H8N2O2/c1-6(12)10-7-3-2-4-9-8(7)5-11/h2-5H,1H3,(H,10,12)
InChIKeyLIOODTCMJDHIIZ-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.85
Rot. Bonds2

About N-(2-formyl-3-pyridinyl)acetamide

N-(2-formyl-3-pyridinyl)acetamide (PubChem CID 54486982) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is N-(2-formyl-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2-formyl-3-pyridinyl)acetamide
PubChem CID54486982
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC NameN-(2-formyl-3-pyridinyl)acetamide
SMILESCC(=O)Nc1cccnc1C=O
InChIInChI=1S/C8H8N2O2/c1-6(12)10-7-3-2-4-9-8(7)5-11/h2-5H,1H3,(H,10,12)
InChIKeyLIOODTCMJDHIIZ-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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Related Compounds

N-(2-formyl-3-pyridinyl)-2,2-dimethylpropanamide
CID 121217282
N-[2-[(E)-2-[3,5,6-tris[(E)-2-(3-acetamido-2-pyridinyl)ethenyl]pyrazin-2-yl]ethenyl]-3-pyridinyl]acetamide
CID 19937796
N-(3-acetamido-2-formylphenyl)acetamide
CID 54088843
N-[2-(1-hydroxyethyl)-3-pyridinyl]acetamide
CID 133062279
2-acetamido-N-(2-chloro-3-pyridinyl)benzamide
CID 13143772
ethane;N-(2-formylphenyl)acetamide
CID 142055624
3-trimethylstannylpyridine-2-carbaldehyde
CID 10355745
N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 154411578
N-[2-(2-methylimidazol-1-yl)-3-pyridinyl]acetamide
CID 47254863
N-(2-phenacyl-3-pyridinyl)acetamide;hydrochloride
CID 172746297
2-bromo-N-(2-chloro-3-pyridinyl)propanamide
CID 107903037
N-[3-(3-hydroxy-2-pyridinyl)prop-2-enyl]acetamide
CID 169464929

Frequently Asked Questions

What is the IUPAC name of N-(2-formyl-3-pyridinyl)acetamide?
The IUPAC name of N-(2-formyl-3-pyridinyl)acetamide (CID 54486982) is N-(2-formyl-3-pyridinyl)acetamide.
What is the SMILES notation for N-(2-formyl-3-pyridinyl)acetamide?
The canonical SMILES for N-(2-formyl-3-pyridinyl)acetamide is CC(=O)Nc1cccnc1C=O.
What is the InChIKey of N-(2-formyl-3-pyridinyl)acetamide?
The InChIKey is LIOODTCMJDHIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-6(12)10-7-3-2-4-9-8(7)5-11/h2-5H,1H3,(H,10,12).
What are the key properties of N-(2-formyl-3-pyridinyl)acetamide?
N-(2-formyl-3-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-(2-formyl-3-pyridinyl)acetamide is sourced from PubChem (CID 54486982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).