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

C21H20N2O3 — CID 42878469

IUPACN-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(Oc2c(C)cccc2C)nc1
InChIInChI=1S/C21H20N2O3/c1-14-7-6-8-15(2)20(14)26-19-12-11-16(13-22-19)23-21(24)17-9-4-5-10-18(17)25-3/h4-13H,1-3H3,(H,23,24)
InChIKeyXOQDRCNIHLTFAG-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.75
Rot. Bonds5

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

N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide (PubChem CID 42878469) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide
PubChem CID42878469
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(Oc2c(C)cccc2C)nc1
InChIInChI=1S/C21H20N2O3/c1-14-7-6-8-15(2)20(14)26-19-12-11-16(13-22-19)23-21(24)17-9-4-5-10-18(17)25-3/h4-13H,1-3H3,(H,23,24)
InChIKeyXOQDRCNIHLTFAG-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

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Related Compounds

2-methoxy-N-[6-(3-methylphenoxy)-3-pyridinyl]benzamide
CID 42878441
2-methoxy-N-[6-(4-methylanilino)-3-pyridinyl]benzamide
CID 113016337
[5-[(2-methoxybenzoyl)amino]-2-pyridinyl] N-methyl-N-phenylcarbamate
CID 11474370
(2R)-2-[[6-(2,6-dimethylphenoxy)-3-pyridinyl]amino]propanamide
CID 67235320
N-[6-(tert-butylamino)-3-pyridinyl]-2-methoxybenzamide
CID 113014776
N-(6-methoxy-3-pyridinyl)-2-phenylmethoxybenzamide
CID 2344191
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
2-(ethylamino)-N-(6-methoxy-3-pyridinyl)benzamide
CID 62165993
2-(dimethylamino)-N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 55965315
N-(6-methoxy-3-pyridinyl)-2-[[2-(2-methylphenyl)acetyl]amino]benzamide
CID 47090938
N-[[6-(2,6-dichlorophenoxy)-3-pyridinyl]carbamoyl]-2,6-dimethoxybenzamide
CID 12912829
2-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 7741659

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide (CID 42878469) is N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(Oc2c(C)cccc2C)nc1.
What is the InChIKey of N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide?
The InChIKey is XOQDRCNIHLTFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-14-7-6-8-15(2)20(14)26-19-12-11-16(13-22-19)23-21(24)17-9-4-5-10-18(17)25-3/h4-13H,1-3H3,(H,23,24).
What are the key properties of N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide?
N-[6-(2,6-dimethylphenoxy)-3-pyridinyl]-2-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-(2,6-dimethylphenoxy)-3-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 42878469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).