2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide

C26H25N3O3 — CID 36551375

IUPAC2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide
SMILESCOc1cc(C)ccc1Oc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cn1
InChIInChI=1S/C26H25N3O3/c1-16-9-11-23(24(13-16)31-4)32-26-12-10-19(15-27-26)29-25(30)14-21-17(2)20-7-5-6-8-22(20)28-18(21)3/h5-13,15H,14H2,1-4H3,(H,29,30)
InChIKeyWEEFQQYRNSNFMO-UHFFFAOYSA-N
MW427.50 g/mol
LogP5.54
Rot. Bonds6

About 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide

2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide (PubChem CID 36551375) has the molecular formula C26H25N3O3 and a molecular weight of 427.50 g/mol. Its IUPAC name is 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide
PubChem CID36551375
Molecular FormulaC26H25N3O3
Molecular Weight427.50 g/mol
Exact Mass427.19
IUPAC Name2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide
SMILESCOc1cc(C)ccc1Oc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cn1
InChIInChI=1S/C26H25N3O3/c1-16-9-11-23(24(13-16)31-4)32-26-12-10-19(15-27-26)29-25(30)14-21-17(2)20-7-5-6-8-22(20)28-18(21)3/h5-13,15H,14H2,1-4H3,(H,29,30)
InChIKeyWEEFQQYRNSNFMO-UHFFFAOYSA-N
XLogP5.54
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.50
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide with MolForge

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 26364618
N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 55674879
2-(2,4-dimethylquinolin-3-yl)-N-quinolin-3-ylacetamide
CID 18146501
2-(2,4-dimethylquinolin-3-yl)-N-pyridin-3-ylacetamide
CID 32789123
2-(2,4-dimethylquinolin-3-yl)-N-(4-iodophenyl)acetamide
CID 8886793
1-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]-3-pentylurea
CID 52627553
N-(2-chloro-4-methylphenyl)-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 8885866
N-[3-(3-cyanopropoxy)phenyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 52698958
N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-2-(2,4-dimethylquinolin-3-yl)acetamide
CID 43000493
3-[2-[[2-(2,4-dimethylquinolin-3-yl)acetyl]amino]phenoxy]propanamide
CID 60530589
2-(dimethylamino)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 55965315
ethyl 6-[[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]carbamoyl]-2-methylpyridine-3-carboxylate
CID 55677621

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide?
The IUPAC name of 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide (CID 36551375) is 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide is COc1cc(C)ccc1Oc1ccc(NC(=O)Cc2c(C)nc3ccccc3c2C)cn1.
What is the InChIKey of 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide?
The InChIKey is WEEFQQYRNSNFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O3/c1-16-9-11-23(24(13-16)31-4)32-26-12-10-19(15-27-26)29-25(30)14-21-17(2)20-7-5-6-8-22(20)28-18(21)3/h5-13,15H,14H2,1-4H3,(H,29,30).
What are the key properties of 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide?
2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide has a molecular weight of 427.50 g/mol, XLogP of 5.54, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylquinolin-3-yl)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]acetamide is sourced from PubChem (CID 36551375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).