2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide

C15H15ClN2O2 — CID 5172267

IUPAC2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide
SMILESCc1cccc(NC(=O)C(C)Oc2cccc(Cl)c2)n1
InChIInChI=1S/C15H15ClN2O2/c1-10-5-3-8-14(17-10)18-15(19)11(2)20-13-7-4-6-12(16)9-13/h3-9,11H,1-2H3,(H,17,18,19)
InChIKeyAEOJKPRDVPHTTM-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.45
Rot. Bonds4

About 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide

2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide (PubChem CID 5172267) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide
PubChem CID5172267
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide
SMILESCc1cccc(NC(=O)C(C)Oc2cccc(Cl)c2)n1
InChIInChI=1S/C15H15ClN2O2/c1-10-5-3-8-14(17-10)18-15(19)11(2)20-13-7-4-6-12(16)9-13/h3-9,11H,1-2H3,(H,17,18,19)
InChIKeyAEOJKPRDVPHTTM-UHFFFAOYSA-N
XLogP3.45
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 ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide (CID 5172267) is 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide is Cc1cccc(NC(=O)C(C)Oc2cccc(Cl)c2)n1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide?
The InChIKey is AEOJKPRDVPHTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-5-3-8-14(17-10)18-15(19)11(2)20-13-7-4-6-12(16)9-13/h3-9,11H,1-2H3,(H,17,18,19).
What are the key properties of 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide?
2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide has a molecular weight of 290.75 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(6-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 5172267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).