N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide

C22H23N3O3 — CID 113017092

IUPACN-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(Nc2cc(C)cc(C)c2)nc1
InChIInChI=1S/C22H23N3O3/c1-15-10-16(2)12-18(11-15)24-21-9-8-17(13-23-21)25-22(26)14-28-20-7-5-4-6-19(20)27-3/h4-13H,14H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyNYDXTLQBKZEGCS-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.47
Rot. Bonds7

About N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide

N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 113017092) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
PubChem CID113017092
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(Nc2cc(C)cc(C)c2)nc1
InChIInChI=1S/C22H23N3O3/c1-15-10-16(2)12-18(11-15)24-21-9-8-17(13-23-21)25-22(26)14-28-20-7-5-4-6-19(20)27-3/h4-13H,14H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyNYDXTLQBKZEGCS-UHFFFAOYSA-N
XLogP4.47
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(3-chloro-4-methylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113018928
2-(2-methoxyphenoxy)-N-[6-(3-methylanilino)pyridazin-3-yl]acetamide
CID 113045737
N-[5-(2,5-dimethylanilino)-2-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113032048
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-(2-methoxyphenoxy)-N-[5-(2-methylanilino)-2-pyridinyl]acetamide
CID 113031340
2-(2-methoxyphenoxy)-N-[6-(2-methylpropylamino)-3-pyridinyl]acetamide
CID 113009626
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
N-[6-(cyclohexylamino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113010088
N-[6-(cycloheptylamino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113014933
2-(2-methoxyphenoxy)-N-[6-(2,4,6-trimethylanilino)pyridazin-3-yl]acetamide
CID 113047016
N-[6-(3,4-dimethylanilino)-3-pyridinyl]-2-phenoxyacetamide
CID 113016981
N-[6-(3,4-dimethoxyanilino)-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113020114

Frequently Asked Questions

What is the IUPAC name of N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide (CID 113017092) is N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1ccc(Nc2cc(C)cc(C)c2)nc1.
What is the InChIKey of N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is NYDXTLQBKZEGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15-10-16(2)12-18(11-15)24-21-9-8-17(13-23-21)25-22(26)14-28-20-7-5-4-6-19(20)27-3/h4-13H,14H2,1-3H3,(H,23,24)(H,25,26).
What are the key properties of N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide?
N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 377.44 g/mol, XLogP of 4.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3,5-dimethylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 113017092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).