2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide

C15H14ClFN2O2 — CID 53184849

IUPAC2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ncccc1CNC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClFN2O2/c1-21-15-10(4-3-7-18-15)9-19-14(20)8-11-12(16)5-2-6-13(11)17/h2-7H,8-9H2,1H3,(H,19,20)
InChIKeyJKDCDNRXLJSPHO-UHFFFAOYSA-N
MW308.74 g/mol
LogP2.74
Rot. Bonds5

About 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide

2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide (PubChem CID 53184849) has the molecular formula C15H14ClFN2O2 and a molecular weight of 308.74 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
PubChem CID53184849
Molecular FormulaC15H14ClFN2O2
Molecular Weight308.74 g/mol
Exact Mass308.07
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ncccc1CNC(=O)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H14ClFN2O2/c1-21-15-10(4-3-7-18-15)9-19-14(20)8-11-12(16)5-2-6-13(11)17/h2-7H,8-9H2,1H3,(H,19,20)
InChIKeyJKDCDNRXLJSPHO-UHFFFAOYSA-N
XLogP2.74
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.74
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide (CID 53184849) is 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide is COc1ncccc1CNC(=O)Cc1c(F)cccc1Cl.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The InChIKey is JKDCDNRXLJSPHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O2/c1-21-15-10(4-3-7-18-15)9-19-14(20)8-11-12(16)5-2-6-13(11)17/h2-7H,8-9H2,1H3,(H,19,20).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide has a molecular weight of 308.74 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 53184849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).