N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide

C13H13FN4O — CID 106895590

IUPACN-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
SMILESO=C(CNCc1cccnn1)Nc1ccc(F)cc1
InChIInChI=1S/C13H13FN4O/c14-10-3-5-11(6-4-10)17-13(19)9-15-8-12-2-1-7-16-18-12/h1-7,15H,8-9H2,(H,17,19)
InChIKeyLLZAFKFKEBJJKC-UHFFFAOYSA-N
MW260.27 g/mol
LogP1.34
Rot. Bonds5

About N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide

N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide (PubChem CID 106895590) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
PubChem CID106895590
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC NameN-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
SMILESO=C(CNCc1cccnn1)Nc1ccc(F)cc1
InChIInChI=1S/C13H13FN4O/c14-10-3-5-11(6-4-10)17-13(19)9-15-8-12-2-1-7-16-18-12/h1-7,15H,8-9H2,(H,17,19)
InChIKeyLLZAFKFKEBJJKC-UHFFFAOYSA-N
XLogP1.34
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895878
N-(2-chlorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895695
N-(4-fluorophenyl)-2-(pyridin-4-ylmethylamino)acetamide
CID 17066841
N-(4-fluorophenyl)-2-[(2-methyl-1,3-thiazol-4-yl)methylamino]acetamide
CID 61283431
2-(2,2-difluoroethylamino)-N-(4-fluorophenyl)acetamide
CID 115406808
2-(ethylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896183
2-(prop-2-enylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896069
N-(3,4-difluorophenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 47107070
N-(4-fluorophenyl)-2-(2-hydroxypropylamino)acetamide
CID 43389711
N-(4-fluorophenyl)-2-(propylamino)acetamide
CID 28586343
N-(4-fluorophenyl)-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]acetamide
CID 106398064
N-(4-fluorophenyl)-2-(prop-2-ynylamino)acetamide
CID 28563124

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide (CID 106895590) is N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide is O=C(CNCc1cccnn1)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide?
The InChIKey is LLZAFKFKEBJJKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c14-10-3-5-11(6-4-10)17-13(19)9-15-8-12-2-1-7-16-18-12/h1-7,15H,8-9H2,(H,17,19).
What are the key properties of N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide?
N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide has a molecular weight of 260.27 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide is sourced from PubChem (CID 106895590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).