2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide

C14H13FN2O — CID 112532440

IUPAC2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C14H13FN2O/c1-10-6-7-12(9-16-10)17-14(18)8-11-4-2-3-5-13(11)15/h2-7,9H,8H2,1H3,(H,17,18)
InChIKeyMNYGJRUTFYATKK-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.71
Rot. Bonds3

About 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide

2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide (PubChem CID 112532440) has the molecular formula C14H13FN2O and a molecular weight of 244.27 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide
PubChem CID112532440
Molecular FormulaC14H13FN2O
Molecular Weight244.27 g/mol
Exact Mass244.10
IUPAC Name2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)Cc2ccccc2F)cn1
InChIInChI=1S/C14H13FN2O/c1-10-6-7-12(9-16-10)17-14(18)8-11-4-2-3-5-13(11)15/h2-7,9H,8H2,1H3,(H,17,18)
InChIKeyMNYGJRUTFYATKK-UHFFFAOYSA-N
XLogP2.71
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide (CID 112532440) is 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide is Cc1ccc(NC(=O)Cc2ccccc2F)cn1.
What is the InChIKey of 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide?
The InChIKey is MNYGJRUTFYATKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O/c1-10-6-7-12(9-16-10)17-14(18)8-11-4-2-3-5-13(11)15/h2-7,9H,8H2,1H3,(H,17,18).
What are the key properties of 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide?
2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide has a molecular weight of 244.27 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 112532440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).