N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide

C14H16N4O2 — CID 113048531

IUPACN-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide
SMILESCOc1ccc(C)cc1Nc1ccc(NC(C)=O)nn1
InChIInChI=1S/C14H16N4O2/c1-9-4-5-12(20-3)11(8-9)16-14-7-6-13(17-18-14)15-10(2)19/h4-8H,1-3H3,(H,16,18)(H,15,17,19)
InChIKeyPCEXKCOSUCSPAE-UHFFFAOYSA-N
MW272.31 g/mol
LogP2.50
Rot. Bonds4

About N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide

N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide (PubChem CID 113048531) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide.

Molecular Properties

Compound NameN-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide
PubChem CID113048531
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide
SMILESCOc1ccc(C)cc1Nc1ccc(NC(C)=O)nn1
InChIInChI=1S/C14H16N4O2/c1-9-4-5-12(20-3)11(8-9)16-14-7-6-13(17-18-14)15-10(2)19/h4-8H,1-3H3,(H,16,18)(H,15,17,19)
InChIKeyPCEXKCOSUCSPAE-UHFFFAOYSA-N
XLogP2.50
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113048581
2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
CID 113048567
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]-2-(2-methylphenyl)acetamide
CID 113048579
6-(2-methoxy-5-methylanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109129383
N-[4-(2-methoxy-5-methylanilino)phenyl]acetamide
CID 112987716
6-(2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridazine-3-carboxamide
CID 109129147
2-chloro-6-fluoro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
CID 113048572
N-[6-(2,5-dimethoxyanilino)pyridazin-3-yl]-2-(4-methylphenoxy)acetamide
CID 113048769
6-(2-methoxy-5-methylanilino)-N-prop-2-enylpyridazine-3-carboxamide
CID 109110513
N-(2-cyanophenyl)-6-(2-methoxy-5-methylanilino)pyridazine-3-carboxamide
CID 109129563
N-[6-(5-chloro-2-methoxyanilino)pyridazin-3-yl]-2,2-dimethylpropanamide
CID 113047959
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]-3,4-dimethylbenzenesulfonamide
CID 113048599

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide?
The IUPAC name of N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide (CID 113048531) is N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide.
What is the SMILES notation for N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide?
The canonical SMILES for N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide is COc1ccc(C)cc1Nc1ccc(NC(C)=O)nn1.
What is the InChIKey of N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide?
The InChIKey is PCEXKCOSUCSPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-9-4-5-12(20-3)11(8-9)16-14-7-6-13(17-18-14)15-10(2)19/h4-8H,1-3H3,(H,16,18)(H,15,17,19).
What are the key properties of N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide?
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide has a molecular weight of 272.31 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113048531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).