N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide

C16H20N4O2 — CID 113048085

IUPACN-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2ccccc2OC)nn1
InChIInChI=1S/C16H20N4O2/c1-3-4-9-16(21)18-15-11-10-14(19-20-15)17-12-7-5-6-8-13(12)22-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyICRUDIYRHSUPTI-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.36
Rot. Bonds7

About N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide

N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide (PubChem CID 113048085) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide.

Molecular Properties

Compound NameN-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide
PubChem CID113048085
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide
SMILESCCCCC(=O)Nc1ccc(Nc2ccccc2OC)nn1
InChIInChI=1S/C16H20N4O2/c1-3-4-9-16(21)18-15-11-10-14(19-20-15)17-12-7-5-6-8-13(12)22-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyICRUDIYRHSUPTI-UHFFFAOYSA-N
XLogP3.36
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(2-ethylanilino)pyridazin-3-yl]pentanamide
CID 113046636
N-[4-(2-methoxyanilino)phenyl]pentanamide
CID 112987324
N-[6-(2-methoxyanilino)pyridazin-3-yl]-2,2-dimethylpropanamide
CID 113048089
N-[6-(2-propan-2-yloxyanilino)pyridazin-3-yl]butanamide
CID 113048612
N-[6-(3-methoxyanilino)pyridazin-3-yl]pentanamide
CID 113048182
6-(2-methoxyanilino)-N-pentylpyridazine-3-carboxamide
CID 109125507
N-[6-(2,3-dichloroanilino)pyridazin-3-yl]pentanamide
CID 113050912
N-[(2-methoxyphenyl)carbamothioyl]pentanamide
CID 19187716
N-[6-(2-fluoroanilino)pyridazin-3-yl]butanamide
CID 113047136
2-(2-methoxyphenoxy)-N-[6-(2-propan-2-ylanilino)pyridazin-3-yl]acetamide
CID 113046934
N-(4-methoxy-3-pyridinyl)pentanamide
CID 60608647
[2-(pentanoylamino)phenyl] formate
CID 54559360

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide?
The IUPAC name of N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide (CID 113048085) is N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide.
What is the SMILES notation for N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide?
The canonical SMILES for N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide is CCCCC(=O)Nc1ccc(Nc2ccccc2OC)nn1.
What is the InChIKey of N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide?
The InChIKey is ICRUDIYRHSUPTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-3-4-9-16(21)18-15-11-10-14(19-20-15)17-12-7-5-6-8-13(12)22-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)(H,18,20,21).
What are the key properties of N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide?
N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide has a molecular weight of 300.36 g/mol, XLogP of 3.36, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyanilino)pyridazin-3-yl]pentanamide is sourced from PubChem (CID 113048085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).