4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine

C15H15N5O — CID 104670632

IUPAC4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine
SMILESCOc1ccc(C)cc1-c1c(N)n[nH]c1-c1ccnnc1
InChIInChI=1S/C15H15N5O/c1-9-3-4-12(21-2)11(7-9)13-14(19-20-15(13)16)10-5-6-17-18-8-10/h3-8H,1-2H3,(H3,16,19,20)
InChIKeyPMLPAEUKXQSSQL-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.43
Rot. Bonds3

About 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine

4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine (PubChem CID 104670632) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine
PubChem CID104670632
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine
SMILESCOc1ccc(C)cc1-c1c(N)n[nH]c1-c1ccnnc1
InChIInChI=1S/C15H15N5O/c1-9-3-4-12(21-2)11(7-9)13-14(19-20-15(13)16)10-5-6-17-18-8-10/h3-8H,1-2H3,(H3,16,19,20)
InChIKeyPMLPAEUKXQSSQL-UHFFFAOYSA-N
XLogP2.43
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-iodothiophen-3-yl)-4-(2-methoxy-5-methylphenyl)-1H-pyrazol-3-amine
CID 79691856
5-(3-chlorothiophen-2-yl)-4-(2-methoxy-5-methylphenyl)-1H-pyrazol-3-amine
CID 80644038
5-(2-bromofuran-3-yl)-4-(2-methoxy-5-methylphenyl)-1H-pyrazol-3-amine
CID 106854526
4-(4-fluorophenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine
CID 104670630
4-(5-chloro-2-methoxyphenyl)-5-(5-iodothiophen-3-yl)-1H-pyrazol-3-amine
CID 79691857
5-(2-methoxy-5-methylphenyl)-1H-imidazol-4-amine
CID 82469801
4-(3-methoxy-4-methylphenyl)-5-pyrimidin-5-yl-1H-pyrazol-3-amine
CID 102921933
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-amine
CID 62482749
4-methoxy-6-(2-methoxy-5-methylphenyl)pyrimidin-2-amine
CID 114052966
4-(3-methylphenyl)-5-(4-methylphenyl)-1H-pyrazol-3-amine
CID 62829235
5-cyclopentyl-4-(2-methoxy-5-methylphenyl)-1,2-oxazol-3-amine
CID 66200945
5-(2-fluoro-4-methylphenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine
CID 80524485

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine?
The IUPAC name of 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine (CID 104670632) is 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine?
The canonical SMILES for 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine is COc1ccc(C)cc1-c1c(N)n[nH]c1-c1ccnnc1.
What is the InChIKey of 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine?
The InChIKey is PMLPAEUKXQSSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-9-3-4-12(21-2)11(7-9)13-14(19-20-15(13)16)10-5-6-17-18-8-10/h3-8H,1-2H3,(H3,16,19,20).
What are the key properties of 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine?
4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine has a molecular weight of 281.32 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-5-methylphenyl)-5-pyridazin-4-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 104670632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).