N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide

C23H24N2O3 — CID 25337421

IUPACN-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
SMILESCCOc1cc(C(=O)Nc2ccc(C)cc2C)ccc1OCc1ccncc1
InChIInChI=1S/C23H24N2O3/c1-4-27-22-14-19(23(26)25-20-7-5-16(2)13-17(20)3)6-8-21(22)28-15-18-9-11-24-12-10-18/h5-14H,4,15H2,1-3H3,(H,25,26)
InChIKeyIBOIAFLXOZPADF-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.93
Rot. Bonds7

About N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide

N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide (PubChem CID 25337421) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
PubChem CID25337421
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
SMILESCCOc1cc(C(=O)Nc2ccc(C)cc2C)ccc1OCc1ccncc1
InChIInChI=1S/C23H24N2O3/c1-4-27-22-14-19(23(26)25-20-7-5-16(2)13-17(20)3)6-8-21(22)28-15-18-9-11-24-12-10-18/h5-14H,4,15H2,1-3H3,(H,25,26)
InChIKeyIBOIAFLXOZPADF-UHFFFAOYSA-N
XLogP4.93
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[3-ethoxy-4-(pyridin-4-ylmethoxy)benzoyl]amino]-2-hydroxybenzoate
CID 56576167
3-ethoxy-N'-(4-ethylbenzoyl)-4-(pyridin-4-ylmethoxy)benzohydrazide
CID 55576010
3,4-diethoxy-N-(2-hydroxy-4-methylphenyl)benzamide
CID 26864885
3-bromo-N-(2,4-dimethylphenyl)-4-phenylmethoxybenzamide
CID 54793446
3-ethoxy-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-4-(pyridin-4-ylmethoxy)benzamide
CID 30798544
3-ethoxy-N-(1-methylpyrazol-3-yl)-4-(pyridin-4-ylmethoxy)benzamide
CID 39681534
N-[2-(3,4-diethoxyphenyl)ethyl]-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide
CID 46535133
3-ethoxy-N-(3-iodophenyl)-4-[(4-methylphenyl)methoxy]benzamide
CID 3328427
3-ethoxy-N-(4-methylphenyl)-4-phenylmethoxybenzamide
CID 126086097
4-ethoxy-N-(2-ethoxy-4-methylphenyl)-3-methoxybenzamide
CID 87027059
N'-(3,4-diethoxybenzoyl)-2,4-dimethylbenzohydrazide
CID 7600078
N-(2,4-dimethylphenyl)-3-methoxy-4-propoxybenzamide
CID 2600021

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide?
The IUPAC name of N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide (CID 25337421) is N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide is CCOc1cc(C(=O)Nc2ccc(C)cc2C)ccc1OCc1ccncc1.
What is the InChIKey of N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide?
The InChIKey is IBOIAFLXOZPADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-4-27-22-14-19(23(26)25-20-7-5-16(2)13-17(20)3)6-8-21(22)28-15-18-9-11-24-12-10-18/h5-14H,4,15H2,1-3H3,(H,25,26).
What are the key properties of N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide?
N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide has a molecular weight of 376.46 g/mol, XLogP of 4.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-3-ethoxy-4-(pyridin-4-ylmethoxy)benzamide is sourced from PubChem (CID 25337421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).