N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide

C21H20N2O3 — CID 42691206

IUPACN-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Oc3cc(C)ccc3C)nc2)cc1
InChIInChI=1S/C21H20N2O3/c1-14-4-5-15(2)19(12-14)26-20-11-8-17(13-22-20)23-21(24)16-6-9-18(25-3)10-7-16/h4-13H,1-3H3,(H,23,24)
InChIKeyHNFRVAKDVJPIJM-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.75
Rot. Bonds5

About N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide

N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide (PubChem CID 42691206) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide
PubChem CID42691206
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(Oc3cc(C)ccc3C)nc2)cc1
InChIInChI=1S/C21H20N2O3/c1-14-4-5-15(2)19(12-14)26-20-11-8-17(13-22-20)23-21(24)16-6-9-18(25-3)10-7-16/h4-13H,1-3H3,(H,23,24)
InChIKeyHNFRVAKDVJPIJM-UHFFFAOYSA-N
XLogP4.75
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[6-(2,4-dichlorophenoxy)-3-pyridinyl]-4-methylbenzamide
CID 40541033
1-(4-methoxyphenyl)-3-[6-(4-methylphenoxy)-3-pyridinyl]urea
CID 42691260
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-4-methoxybenzamide
CID 113032033
N-[6-(2,3-dimethylphenoxy)-3-pyridinyl]-4-phenoxybenzamide
CID 173468677
N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033
4-bromo-N-[3-[[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]amino]-3-oxopropyl]benzamide
CID 55675161
4-bromo-N-[6-(4-fluorophenoxy)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 55713973
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
2-methoxy-N-[6-(3-methylphenoxy)-3-pyridinyl]benzamide
CID 42878441
N-[6-(4-chloro-2-methylphenoxy)-3-pyridinyl]naphthalene-2-carboxamide
CID 18419514
5-chloro-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]furan-2-carboxamide
CID 55675140
N-(3,5-dimethoxyphenyl)-3-methoxy-4-methylbenzamide
CID 16619720

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide?
The IUPAC name of N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide (CID 42691206) is N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide.
What is the SMILES notation for N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide?
The canonical SMILES for N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(Oc3cc(C)ccc3C)nc2)cc1.
What is the InChIKey of N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide?
The InChIKey is HNFRVAKDVJPIJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-14-4-5-15(2)19(12-14)26-20-11-8-17(13-22-20)23-21(24)16-6-9-18(25-3)10-7-16/h4-13H,1-3H3,(H,23,24).
What are the key properties of N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide?
N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide has a molecular weight of 348.40 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,5-dimethylphenoxy)-3-pyridinyl]-4-methoxybenzamide is sourced from PubChem (CID 42691206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).