3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide

C17H20N2O2 — CID 47023614

IUPAC3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCOc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C17H20N2O2/c1-12-4-7-16(18-11-12)19-17(20)8-9-21-15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9H2,1-3H3,(H,18,19,20)
InChIKeyZTKKKUUTLGPECC-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.41
Rot. Bonds5

About 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide

3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide (PubChem CID 47023614) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide
PubChem CID47023614
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCOc2ccc(C)c(C)c2)nc1
InChIInChI=1S/C17H20N2O2/c1-12-4-7-16(18-11-12)19-17(20)8-9-21-15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9H2,1-3H3,(H,18,19,20)
InChIKeyZTKKKUUTLGPECC-UHFFFAOYSA-N
XLogP3.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-chlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 47325752
3-methoxy-N-(5-methyl-2-pyridinyl)propanamide
CID 127118084
4-(4-acetylphenoxy)-N-(5-methyl-2-pyridinyl)butanamide
CID 35344400
3-(3,4-dimethylphenoxy)-N-(4,5-dimethyl-1H-pyrazol-3-yl)propanamide
CID 115610256
N-(5-iodo-2-pyridinyl)-3-(3-methylphenoxy)propanamide
CID 65098554
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-3-phenoxypropanamide
CID 113032043
methyl 4-[(5-methyl-2-pyridinyl)amino]-4-oxobutanoate
CID 47150722
N-(5-amino-2-methylphenyl)-3-(3,4-dimethylphenoxy)propanamide;hydrochloride
CID 120568118
3-(3,4-dimethylphenoxy)-N-(2-ethylphenyl)propanamide
CID 39992819
6-methoxy-N-(5-methyl-2-pyridinyl)hexanamide
CID 158537293
N-(5-methyl-2-pyridinyl)-3-(2-phenylphenoxy)propanamide
CID 52710581
4-(3,4-dimethylphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 145420181

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The IUPAC name of 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide (CID 47023614) is 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide is Cc1ccc(NC(=O)CCOc2ccc(C)c(C)c2)nc1.
What is the InChIKey of 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
The InChIKey is ZTKKKUUTLGPECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-4-7-16(18-11-12)19-17(20)8-9-21-15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9H2,1-3H3,(H,18,19,20).
What are the key properties of 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide?
3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide has a molecular weight of 284.36 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 47023614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).