2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide

C19H19N3O2 — CID 43905420

IUPAC2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(-n2ccnc2C)cc1
InChIInChI=1S/C19H19N3O2/c1-14-20-11-12-22(14)16-9-7-15(8-10-16)13-21-19(23)17-5-3-4-6-18(17)24-2/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyTUTJEWWLIYPLJD-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.12
Rot. Bonds5

About 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide

2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide (PubChem CID 43905420) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
PubChem CID43905420
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(-n2ccnc2C)cc1
InChIInChI=1S/C19H19N3O2/c1-14-20-11-12-22(14)16-9-7-15(8-10-16)13-21-19(23)17-5-3-4-6-18(17)24-2/h3-12H,13H2,1-2H3,(H,21,23)
InChIKeyTUTJEWWLIYPLJD-UHFFFAOYSA-N
XLogP3.12
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dimethoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
CID 92679900
2-(3,4-dimethoxyphenyl)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide
CID 92680069
2-benzylsulfanyl-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
CID 43908476
2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]-5-pyrrolidin-1-ylsulfonylbenzamide
CID 92673076
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide
CID 43907556
2-[benzenesulfonyl(methyl)amino]-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide
CID 92679888
2-(2-chlorophenyl)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide
CID 100632169
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]pyridine-3-carboxamide
CID 53159101
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]furan-3-carboxamide
CID 53159097
5-ethoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]furan-2-carboxamide
CID 91795041
2-methoxy-N-[(4-phenylmethoxyphenyl)methyl]benzamide
CID 46586786
N-[[3-fluoro-4-(2-methylimidazol-1-yl)phenyl]methyl]-2,3,4-trimethoxybenzamide
CID 47738339

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide?
The IUPAC name of 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide (CID 43905420) is 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide?
The canonical SMILES for 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide is COc1ccccc1C(=O)NCc1ccc(-n2ccnc2C)cc1.
What is the InChIKey of 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide?
The InChIKey is TUTJEWWLIYPLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-14-20-11-12-22(14)16-9-7-15(8-10-16)13-21-19(23)17-5-3-4-6-18(17)24-2/h3-12H,13H2,1-2H3,(H,21,23).
What are the key properties of 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide?
2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide has a molecular weight of 321.38 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]benzamide is sourced from PubChem (CID 43905420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).