5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide

C18H16FN3O2 — CID 136578547

IUPAC5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1cccc(-c2nccn2C)c1
InChIInChI=1S/C18H16FN3O2/c1-22-9-8-20-17(22)12-4-3-5-14(10-12)21-18(23)15-11-13(19)6-7-16(15)24-2/h3-11H,1-2H3,(H,21,23)
InChIKeyVGMWKLJNUGFYLZ-UHFFFAOYSA-N
MW325.34 g/mol
LogP3.49
Rot. Bonds4

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

5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide (PubChem CID 136578547) has the molecular formula C18H16FN3O2 and a molecular weight of 325.34 g/mol. Its IUPAC name is 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide
PubChem CID136578547
Molecular FormulaC18H16FN3O2
Molecular Weight325.34 g/mol
Exact Mass325.12
IUPAC Name5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1cccc(-c2nccn2C)c1
InChIInChI=1S/C18H16FN3O2/c1-22-9-8-20-17(22)12-4-3-5-14(10-12)21-18(23)15-11-13(19)6-7-16(15)24-2/h3-11H,1-2H3,(H,21,23)
InChIKeyVGMWKLJNUGFYLZ-UHFFFAOYSA-N
XLogP3.49
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-fluoro-2-methoxy-N-pyridin-3-ylbenzamide
CID 34947016
5-fluoro-2-methoxy-N-[3-(trifluoromethyl)phenyl]benzamide
CID 34754187
3-ethyl-6-methyl-N-[3-(1-methylimidazol-2-yl)phenyl]pyridazine-4-carboxamide
CID 136530773
N-[3-(1-methylimidazol-2-yl)phenyl]furan-2-carboxamide
CID 136578540
N-(3-ethynylphenyl)-5-fluoro-2-methoxybenzamide
CID 33229993
N-(4-acetamidophenyl)-5-fluoro-2-methoxybenzamide
CID 31063829
3-methyl-N-[3-(1-methylimidazol-2-yl)phenyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 167916723
2-(2-cyanophenyl)sulfanyl-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide
CID 60557057
5-methyl-N-[3-(1-methylimidazol-2-yl)phenyl]-3-phenyl-1,2-oxazole-4-carboxamide
CID 60557129
4-amino-N-[3-(1-methylimidazol-2-yl)phenyl]butanamide
CID 119856092
N-[3-(1-methylimidazol-2-yl)phenyl]-1,3-dihydroisoindole-2-carboxamide
CID 84584319
1-(2-hydroxyethyl)-1-methyl-3-[3-(1-methylimidazol-2-yl)phenyl]urea
CID 111453463

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide?
The IUPAC name of 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide (CID 136578547) is 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide?
The canonical SMILES for 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide is COc1ccc(F)cc1C(=O)Nc1cccc(-c2nccn2C)c1.
What is the InChIKey of 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide?
The InChIKey is VGMWKLJNUGFYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O2/c1-22-9-8-20-17(22)12-4-3-5-14(10-12)21-18(23)15-11-13(19)6-7-16(15)24-2/h3-11H,1-2H3,(H,21,23).
What are the key properties of 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide?
5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide has a molecular weight of 325.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methoxy-N-[3-(1-methylimidazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 136578547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).