N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide

C16H19N3O3 — CID 46699606

IUPACN-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(N(C)C)nc2)cc1
InChIInChI=1S/C16H19N3O3/c1-19(2)15-9-4-12(10-17-15)18-16(20)11-22-14-7-5-13(21-3)6-8-14/h4-10H,11H2,1-3H3,(H,18,20)
InChIKeyQLBHJSBTNMCEOM-UHFFFAOYSA-N
MW301.35 g/mol
LogP2.17
Rot. Bonds6

About N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide

N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide (PubChem CID 46699606) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide
PubChem CID46699606
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)Nc2ccc(N(C)C)nc2)cc1
InChIInChI=1S/C16H19N3O3/c1-19(2)15-9-4-12(10-17-15)18-16(20)11-22-14-7-5-13(21-3)6-8-14/h4-10H,11H2,1-3H3,(H,18,20)
InChIKeyQLBHJSBTNMCEOM-UHFFFAOYSA-N
XLogP2.17
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[2-[[6-(dimethylamino)-3-pyridinyl]amino]-2-oxoethoxy]phenyl]cyclopropanecarboxamide
CID 39505500
2-(3,5-dimethoxyphenoxy)-N-(4-methoxyphenyl)acetamide
CID 7707204
N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)butanamide
CID 60842943
4-[[2-(4-methoxyphenoxy)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 2710766
N-(4-methoxyphenyl)-2-(4-propoxyphenoxy)acetamide
CID 4732668
N-[6-[2-hydroxyethyl(methyl)amino]-3-pyridinyl]-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 71625320
N-[6-[2-(4-methoxyphenoxy)ethylamino]-3-pyridinyl]-2-phenoxyacetamide
CID 113014703
2-(4-methoxyphenoxy)-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 4940606
4-chloro-N-[6-(dimethylamino)-3-pyridinyl]butanamide
CID 63308097
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 833180
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(4-methoxyphenyl)acetamide
CID 7719333

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide (CID 46699606) is N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide is COc1ccc(OCC(=O)Nc2ccc(N(C)C)nc2)cc1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide?
The InChIKey is QLBHJSBTNMCEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-19(2)15-9-4-12(10-17-15)18-16(20)11-22-14-7-5-13(21-3)6-8-14/h4-10H,11H2,1-3H3,(H,18,20).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide?
N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide has a molecular weight of 301.35 g/mol, XLogP of 2.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide is sourced from PubChem (CID 46699606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).