2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide

C17H20N2O4 — CID 37485782

IUPAC2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2cccnc2OC)c(OC)c1
InChIInChI=1S/C17H20N2O4/c1-21-14-7-6-12(15(10-14)22-2)9-16(20)19-11-13-5-4-8-18-17(13)23-3/h4-8,10H,9,11H2,1-3H3,(H,19,20)
InChIKeyMEQLPTQKVGCCFI-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.97
Rot. Bonds7

About 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide

2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide (PubChem CID 37485782) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
PubChem CID37485782
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC Name2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
SMILESCOc1ccc(CC(=O)NCc2cccnc2OC)c(OC)c1
InChIInChI=1S/C17H20N2O4/c1-21-14-7-6-12(15(10-14)22-2)9-16(20)19-11-13-5-4-8-18-17(13)23-3/h4-8,10H,9,11H2,1-3H3,(H,19,20)
InChIKeyMEQLPTQKVGCCFI-UHFFFAOYSA-N
XLogP1.97
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethoxy-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38533824
1-[(2,4-dimethoxyphenyl)methyl]-3-ethyl-2-[(2-methoxy-3-pyridinyl)methyl]guanidine
CID 111880227
N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
CID 37486176
1-[(4-methoxyphenyl)methyl]-3-[(2-methoxy-3-pyridinyl)methyl]urea
CID 53184866
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-methoxy-3-pyridinyl)methanamine
CID 60761595
4-hydroxy-N-[(2-methoxy-3-pyridinyl)methyl]butanamide
CID 79204552
3-[(4-methoxyphenyl)carbamoylamino]-N-[(2-methoxy-3-pyridinyl)methyl]propanamide
CID 46598865
2-(2,4-dimethoxyphenyl)-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031383
2-(2,4-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
CID 43389932
N-(cyanomethyl)-2-(2,4-dimethoxyphenyl)acetamide
CID 96660716
3-(2-fluorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]propanamide
CID 38534369
2-(4-butylphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide
CID 37485449

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide (CID 37485782) is 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide is COc1ccc(CC(=O)NCc2cccnc2OC)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
The InChIKey is MEQLPTQKVGCCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-21-14-7-6-12(15(10-14)22-2)9-16(20)19-11-13-5-4-8-18-17(13)23-3/h4-8,10H,9,11H2,1-3H3,(H,19,20).
What are the key properties of 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide?
2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide has a molecular weight of 316.36 g/mol, XLogP of 1.97, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 37485782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).