N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide

C22H23N3O4 — CID 113019975

IUPACN-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(Nc3cc(OC)ccc3OC)nc2)cc1
InChIInChI=1S/C22H23N3O4/c1-27-17-7-4-15(5-8-17)12-22(26)24-16-6-11-21(23-14-16)25-19-13-18(28-2)9-10-20(19)29-3/h4-11,13-14H,12H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyWWKSTWQWYDXCPP-UHFFFAOYSA-N
MW393.44 g/mol
LogP4.03
Rot. Bonds8

About N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide

N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide (PubChem CID 113019975) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
PubChem CID113019975
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC NameN-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2ccc(Nc3cc(OC)ccc3OC)nc2)cc1
InChIInChI=1S/C22H23N3O4/c1-27-17-7-4-15(5-8-17)12-22(26)24-16-6-11-21(23-14-16)25-19-13-18(28-2)9-10-20(19)29-3/h4-11,13-14H,12H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyWWKSTWQWYDXCPP-UHFFFAOYSA-N
XLogP4.03
TPSA81.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]carbamate
CID 113019994
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-ethylbutanamide
CID 113019957
2-(4-methoxyphenyl)-N-[6-(2,3,4-trifluoroanilino)-3-pyridinyl]acetamide
CID 113023061
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
CID 113034610
N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113018700
2-(4-chlorophenyl)-N-[6-(2,5-dimethoxyanilino)pyridazin-3-yl]acetamide
CID 113048759
2-(4-methoxyphenyl)-N-[6-[(2-methoxyphenyl)methylamino]-3-pyridinyl]acetamide
CID 113012370
2-(4-chlorophenyl)-N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]acetamide
CID 113034700
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113034634
N-[6-(2-chloroanilino)-3-pyridinyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 113018440
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]pyridine-3-carboxamide
CID 113019982
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
CID 113020010

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide (CID 113019975) is N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2ccc(Nc3cc(OC)ccc3OC)nc2)cc1.
What is the InChIKey of N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is WWKSTWQWYDXCPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-27-17-7-4-15(5-8-17)12-22(26)24-16-6-11-21(23-14-16)25-19-13-18(28-2)9-10-20(19)29-3/h4-11,13-14H,12H2,1-3H3,(H,23,25)(H,24,26).
What are the key properties of N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 393.44 g/mol, XLogP of 4.03, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 113019975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).