4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide

C24H25N3O4 — CID 56548346

IUPAC4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide
SMILESCOc1c(C)cnc(CN(C)C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)c1C
InChIInChI=1S/C24H25N3O4/c1-15-13-26-21(16(2)22(15)30-4)14-27(3)24(29)18-7-11-20(12-8-18)31-19-9-5-17(6-10-19)23(25)28/h5-13H,14H2,1-4H3,(H2,25,28)
InChIKeyRROIERRYHIGGPL-UHFFFAOYSA-N
MW419.48 g/mol
LogP3.87
Rot. Bonds7

About 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide

4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide (PubChem CID 56548346) has the molecular formula C24H25N3O4 and a molecular weight of 419.48 g/mol. Its IUPAC name is 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide.

Molecular Properties

Compound Name4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide
PubChem CID56548346
Molecular FormulaC24H25N3O4
Molecular Weight419.48 g/mol
Exact Mass419.18
IUPAC Name4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide
SMILESCOc1c(C)cnc(CN(C)C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)c1C
InChIInChI=1S/C24H25N3O4/c1-15-13-26-21(16(2)22(15)30-4)14-27(3)24(29)18-7-11-20(12-8-18)31-19-9-5-17(6-10-19)23(25)28/h5-13H,14H2,1-4H3,(H2,25,28)
InChIKeyRROIERRYHIGGPL-UHFFFAOYSA-N
XLogP3.87
TPSA94.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.48
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide 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

3,4,5-trimethoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylbenzamide
CID 51128958
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
CID 51100025
3,5-dichloro-4-methoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylbenzamide
CID 51128954
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylpyridine-2-carboxamide
CID 47086432
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,2,5-trimethylpyrazole-3-carboxamide
CID 146085594
(2R)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,2-dimethylpentanamide
CID 95316113
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-methyl-3-(3-methylsulfanylphenyl)urea
CID 118793922
1-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methoxy]phenyl]propan-1-one
CID 43823601
1-(4-aminophenyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanone
CID 116548821
4-[4-[1,3-benzodioxol-5-ylmethyl(methyl)carbamoyl]phenoxy]benzamide
CID 56545342
methyl 5-[[[4-(4-carbamoylphenoxy)benzoyl]-methylamino]methyl]-2-methylfuran-3-carboxylate
CID 56545761
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,3-dimethyl-4-oxo-6,7-dihydro-5H-1-benzofuran-2-carboxamide
CID 71881925

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide?
The IUPAC name of 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide (CID 56548346) is 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide.
What is the SMILES notation for 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide?
The canonical SMILES for 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide is COc1c(C)cnc(CN(C)C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)c1C.
What is the InChIKey of 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide?
The InChIKey is RROIERRYHIGGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O4/c1-15-13-26-21(16(2)22(15)30-4)14-27(3)24(29)18-7-11-20(12-8-18)31-19-9-5-17(6-10-19)23(25)28/h5-13H,14H2,1-4H3,(H2,25,28).
What are the key properties of 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide?
4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide has a molecular weight of 419.48 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylcarbamoyl]phenoxy]benzamide is sourced from PubChem (CID 56548346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).