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

C15H17N3O3 — CID 113020010

IUPACN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
SMILESCOc1ccc(Nc2ccc(NC(C)=O)cn2)c(OC)c1
InChIInChI=1S/C15H17N3O3/c1-10(19)17-11-4-7-15(16-9-11)18-13-6-5-12(20-2)8-14(13)21-3/h4-9H,1-3H3,(H,16,18)(H,17,19)
InChIKeyVCVJBUWYTKVAGE-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.80
Rot. Bonds5

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

N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide (PubChem CID 113020010) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
PubChem CID113020010
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
SMILESCOc1ccc(Nc2ccc(NC(C)=O)cn2)c(OC)c1
InChIInChI=1S/C15H17N3O3/c1-10(19)17-11-4-7-15(16-9-11)18-13-6-5-12(20-2)8-14(13)21-3/h4-9H,1-3H3,(H,16,18)(H,17,19)
InChIKeyVCVJBUWYTKVAGE-UHFFFAOYSA-N
XLogP2.80
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide
CID 113020021
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113020060
N-[6-(4-chloro-2,5-dimethoxyanilino)-3-pyridinyl]acetamide
CID 113022464
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-2,2-dimethylpropanamide
CID 113034682
1-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-phenylurea
CID 113034717
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
CID 113034610
N-[4-[[6-(2,4-dimethoxyanilino)-2-methylpyrimidin-4-yl]amino]phenyl]acetamide
CID 112878632
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-4-methylbenzamide
CID 113034689
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-methoxybenzamide
CID 113034694
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113020065
1-cyclohexyl-3-[5-(2,4-dimethoxyanilino)-2-pyridinyl]urea
CID 113034718
ethyl N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]carbamate
CID 113019994

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide?
The IUPAC name of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide (CID 113020010) is N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide.
What is the SMILES notation for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide?
The canonical SMILES for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide is COc1ccc(Nc2ccc(NC(C)=O)cn2)c(OC)c1.
What is the InChIKey of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide?
The InChIKey is VCVJBUWYTKVAGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10(19)17-11-4-7-15(16-9-11)18-13-6-5-12(20-2)8-14(13)21-3/h4-9H,1-3H3,(H,16,18)(H,17,19).
What are the key properties of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide?
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide has a molecular weight of 287.32 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide is sourced from PubChem (CID 113020010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).