N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide

C15H15ClN2O2 — CID 103730431

IUPACN-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)Nc2cnc(Cl)c(C)c2)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-6-12(9-17-15(10)16)18-14(19)8-11-4-3-5-13(7-11)20-2/h3-7,9H,8H2,1-2H3,(H,18,19)
InChIKeyUEWNCBDOCFTEIZ-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.23
Rot. Bonds4

About N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide

N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide (PubChem CID 103730431) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide
PubChem CID103730431
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)Nc2cnc(Cl)c(C)c2)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-6-12(9-17-15(10)16)18-14(19)8-11-4-3-5-13(7-11)20-2/h3-7,9H,8H2,1-2H3,(H,18,19)
InChIKeyUEWNCBDOCFTEIZ-UHFFFAOYSA-N
XLogP3.23
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide (CID 103730431) is N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide is COc1cccc(CC(=O)Nc2cnc(Cl)c(C)c2)c1.
What is the InChIKey of N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide?
The InChIKey is UEWNCBDOCFTEIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-6-12(9-17-15(10)16)18-14(19)8-11-4-3-5-13(7-11)20-2/h3-7,9H,8H2,1-2H3,(H,18,19).
What are the key properties of N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide?
N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 103730431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).