2-chloro-N-(6-methoxy-3-pyridinyl)acetamide

C8H9ClN2O2 — CID 2561820

IUPAC2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CCl)cn1
InChIInChI=1S/C8H9ClN2O2/c1-13-8-3-2-6(5-10-8)11-7(12)4-9/h2-3,5H,4H2,1H3,(H,11,12)
InChIKeyLEISKMLCFDOLEJ-UHFFFAOYSA-N
MW200.62 g/mol
LogP1.27
Rot. Bonds3

About 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide

2-chloro-N-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 2561820) has the molecular formula C8H9ClN2O2 and a molecular weight of 200.62 g/mol. Its IUPAC name is 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
PubChem CID2561820
Molecular FormulaC8H9ClN2O2
Molecular Weight200.62 g/mol
Exact Mass200.04
IUPAC Name2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CCl)cn1
InChIInChI=1S/C8H9ClN2O2/c1-13-8-3-2-6(5-10-8)11-7(12)4-9/h2-3,5H,4H2,1H3,(H,11,12)
InChIKeyLEISKMLCFDOLEJ-UHFFFAOYSA-N
XLogP1.27
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.62
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-acetamido-N-(6-methoxy-3-pyridinyl)propanamide
CID 47096905
(3Z)-3-amino-3-hydroxyimino-N-(6-methoxy-3-pyridinyl)propanamide
CID 43156078
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
1-(2-hydroxyethyl)-3-(6-methoxy-3-pyridinyl)urea
CID 47237458
2-(cyclopropylamino)-N-(6-methoxy-3-pyridinyl)acetamide
CID 60688381
2-(2-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 16795634
2,3,3-trichloro-N-(6-methoxy-3-pyridinyl)prop-2-enamide
CID 3780869
2-chloro-N-(6-methylsulfonyl-3-pyridinyl)acetamide
CID 43696835
N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide
CID 2486887
3-(2,5-dimethylpyrrol-1-yl)-N-(6-methoxy-3-pyridinyl)propanamide
CID 110204854
2-(3,5-dimethylphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 7478526
3-(2-aminoethoxy)-N-(6-methoxy-3-pyridinyl)propanamide
CID 112738961

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide (CID 2561820) is 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(NC(=O)CCl)cn1.
What is the InChIKey of 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is LEISKMLCFDOLEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2/c1-13-8-3-2-6(5-10-8)11-7(12)4-9/h2-3,5H,4H2,1H3,(H,11,12).
What are the key properties of 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide?
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 200.62 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 2561820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).