3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide

C19H17Cl2N3O3 — CID 55766590

IUPAC3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccc(OCc3nccn3C)cc2)cc1Cl
InChIInChI=1S/C19H17Cl2N3O3/c1-24-8-7-22-17(24)11-27-14-5-3-13(4-6-14)23-19(25)12-9-15(20)18(26-2)16(21)10-12/h3-10H,11H2,1-2H3,(H,23,25)
InChIKeyIYXJVJGGXNWBKU-UHFFFAOYSA-N
MW406.27 g/mol
LogP4.57
Rot. Bonds6

About 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide

3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide (PubChem CID 55766590) has the molecular formula C19H17Cl2N3O3 and a molecular weight of 406.27 g/mol. Its IUPAC name is 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
PubChem CID55766590
Molecular FormulaC19H17Cl2N3O3
Molecular Weight406.27 g/mol
Exact Mass405.06
IUPAC Name3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccc(OCc3nccn3C)cc2)cc1Cl
InChIInChI=1S/C19H17Cl2N3O3/c1-24-8-7-22-17(24)11-27-14-5-3-13(4-6-14)23-19(25)12-9-15(20)18(26-2)16(21)10-12/h3-10H,11H2,1-2H3,(H,23,25)
InChIKeyIYXJVJGGXNWBKU-UHFFFAOYSA-N
XLogP4.57
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.27
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[[4-[(1-methylimidazol-2-yl)methoxy]benzoyl]amino]benzoate
CID 47038275
N-[4-(carbamoylamino)phenyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55793990
N-(3-chloro-4-cyanophenyl)-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55736367
N-[4-(methylcarbamoylamino)phenyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55736611
4-[4-[[4-[(1-methylimidazol-2-yl)methoxy]phenyl]carbamoyl]phenoxy]benzamide
CID 56548654
N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-3-(2-methylpropoxy)benzamide
CID 55766270
N-[5-chloro-2-(4-methoxyphenoxy)phenyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55736273
3-[(4-fluorophenyl)sulfamoyl]-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
CID 55855139
N-[1-[(2-chlorophenyl)methyl]-6-oxo-3-pyridinyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55859027
2-ethoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide
CID 47045513
1-(4-chlorophenyl)-5-methyl-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]-1,2,4-triazole-3-carboxamide
CID 78902007
1-[4-[[4-[(1-methylimidazol-2-yl)methoxy]benzoyl]amino]phenyl]pyrazole-3-carboxamide
CID 56506638

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide?
The IUPAC name of 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide (CID 55766590) is 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide.
What is the SMILES notation for 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide?
The canonical SMILES for 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide is COc1c(Cl)cc(C(=O)Nc2ccc(OCc3nccn3C)cc2)cc1Cl.
What is the InChIKey of 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide?
The InChIKey is IYXJVJGGXNWBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2N3O3/c1-24-8-7-22-17(24)11-27-14-5-3-13(4-6-14)23-19(25)12-9-15(20)18(26-2)16(21)10-12/h3-10H,11H2,1-2H3,(H,23,25).
What are the key properties of 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide?
3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide has a molecular weight of 406.27 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-methoxy-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]benzamide is sourced from PubChem (CID 55766590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).