N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide

C15H17N3O3 — CID 113034610

IUPACN-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
SMILESCOc1ccc(OC)c(Nc2ccc(NC(C)=O)nc2)c1
InChIInChI=1S/C15H17N3O3/c1-10(19)17-15-7-4-11(9-16-15)18-13-8-12(20-2)5-6-14(13)21-3/h4-9,18H,1-3H3,(H,16,17,19)
InChIKeyXHQRDZIWMKHFSQ-UHFFFAOYSA-N
MW287.32 g/mol
LogP2.80
Rot. Bonds5

About N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide

N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide (PubChem CID 113034610) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
PubChem CID113034610
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide
SMILESCOc1ccc(OC)c(Nc2ccc(NC(C)=O)nc2)c1
InChIInChI=1S/C15H17N3O3/c1-10(19)17-15-7-4-11(9-16-15)18-13-8-12(20-2)5-6-14(13)21-3/h4-9,18H,1-3H3,(H,16,17,19)
InChIKeyXHQRDZIWMKHFSQ-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

ethyl N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]carbamate
CID 113034657
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-4-methylbenzamide
CID 113034626
N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]-2-thiophen-2-ylacetamide
CID 113034634
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-2,2-dimethylpropanamide
CID 113034682
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
CID 113020010
N-[5-(5-chloro-2-methoxyanilino)-2-pyridinyl]-4-methoxybenzamide
CID 113033826
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113019975
N-(4-acetylphenyl)-5-(2,5-dimethoxyanilino)pyridine-2-carboxamide
CID 109200201
ethyl N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]carbamate
CID 113019994
N-[6-(2,5-dimethoxyanilino)-3-pyridinyl]-2-ethylbutanamide
CID 113019957
1-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-phenylurea
CID 113034717
N-(2,5-dimethoxyphenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109200105

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide?
The IUPAC name of N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide (CID 113034610) is N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide.
What is the SMILES notation for N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide?
The canonical SMILES for N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide is COc1ccc(OC)c(Nc2ccc(NC(C)=O)nc2)c1.
What is the InChIKey of N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide?
The InChIKey is XHQRDZIWMKHFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10(19)17-15-7-4-11(9-16-15)18-13-8-12(20-2)5-6-14(13)21-3/h4-9,18H,1-3H3,(H,16,17,19).
What are the key properties of N-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide?
N-[5-(2,5-dimethoxyanilino)-2-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-[5-(2,5-dimethoxyanilino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113034610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).