3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide

C15H16N2O2 — CID 23530638

IUPAC3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide
SMILESCOc1cc(C(=O)NCc2ccncc2)ccc1C
InChIInChI=1S/C15H16N2O2/c1-11-3-4-13(9-14(11)19-2)15(18)17-10-12-5-7-16-8-6-12/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyOBQNHOMMOJGTQD-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.33
Rot. Bonds4

About 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide

3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 23530638) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide
PubChem CID23530638
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide
SMILESCOc1cc(C(=O)NCc2ccncc2)ccc1C
InChIInChI=1S/C15H16N2O2/c1-11-3-4-13(9-14(11)19-2)15(18)17-10-12-5-7-16-8-6-12/h3-9H,10H2,1-2H3,(H,17,18)
InChIKeyOBQNHOMMOJGTQD-UHFFFAOYSA-N
XLogP2.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-4-methoxy-N-(pyridin-4-ylmethyl)benzamide
CID 6472060
3-(6-methoxy-7-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide
CID 167695764
4-bromo-3-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 113338678
3,4-dimethoxy-N-[[3-(2-pyridin-4-ylethylcarbamoyl)phenyl]methyl]benzamide
CID 44819015
1-N-(2-methoxyethyl)-4-N-(pyridin-4-ylmethyl)benzene-1,4-dicarboxamide
CID 109045098
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-N-(pyridin-4-ylmethyl)benzamide
CID 51155505
3-methoxy-4-methyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]benzamide
CID 46456572
4-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]-3-(pyridin-4-ylmethoxy)benzamide
CID 31816152
N-(2-aminoethyl)-3-methoxy-4-methylbenzamide
CID 18071038
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-methoxy-4-methylbenzamide
CID 27761365
6-(4-chloro-2-methoxy-5-methylanilino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 109158195
N-(pyridin-4-ylmethyl)-2-(3,4,5-trimethoxyanilino)pyridine-4-carboxamide
CID 109172063

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide (CID 23530638) is 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide is COc1cc(C(=O)NCc2ccncc2)ccc1C.
What is the InChIKey of 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is OBQNHOMMOJGTQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-3-4-13(9-14(11)19-2)15(18)17-10-12-5-7-16-8-6-12/h3-9H,10H2,1-2H3,(H,17,18).
What are the key properties of 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide?
3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 256.31 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-methyl-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 23530638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).