2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide

C20H19N3O2 — CID 110714393

IUPAC2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C20H19N3O2/c1-25-17-8-5-15(6-9-17)12-20(24)23-14-16-7-10-19(22-13-16)18-4-2-3-11-21-18/h2-11,13H,12,14H2,1H3,(H,23,24)
InChIKeyVWDGKHPUUZZPHL-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.01
Rot. Bonds6

About 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide

2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide (PubChem CID 110714393) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide
PubChem CID110714393
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2ccc(-c3ccccn3)nc2)cc1
InChIInChI=1S/C20H19N3O2/c1-25-17-8-5-15(6-9-17)12-20(24)23-14-16-7-10-19(22-13-16)18-4-2-3-11-21-18/h2-11,13H,12,14H2,1H3,(H,23,24)
InChIKeyVWDGKHPUUZZPHL-UHFFFAOYSA-N
XLogP3.01
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenoxy-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide
CID 110714395
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
5-methoxy-2-pyridin-2-ylpyridine
CID 604153
2-(2-hydroxyphenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 2544461
N-(1,3-benzothiazol-2-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 18110654
N-[(4-methoxyphenyl)methyl]-2-pyridin-3-yloxyacetamide
CID 110487955
3-chloro-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]benzamide
CID 110714398
N-[(4-methoxyphenyl)methyl]-4-(2-methylpropanoylamino)-3-pyridin-2-yl-1,2-thiazole-5-carboxamide
CID 53141321
2-(4-methoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide;hydrochloride
CID 142729709
3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
CID 898315
N-[(2-ethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 38009470
N-(1H-indol-3-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 110357464

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide (CID 110714393) is 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide is COc1ccc(CC(=O)NCc2ccc(-c3ccccn3)nc2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is VWDGKHPUUZZPHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-25-17-8-5-15(6-9-17)12-20(24)23-14-16-7-10-19(22-13-16)18-4-2-3-11-21-18/h2-11,13H,12,14H2,1H3,(H,23,24).
What are the key properties of 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide?
2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 333.39 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[(6-pyridin-2-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 110714393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).