5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine

C15H16N6 — CID 104670730

IUPAC5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine
SMILESCCc1nnc(C)cc1-c1[nH]nc(N)c1-c1cccnc1
InChIInChI=1S/C15H16N6/c1-3-12-11(7-9(2)18-19-12)14-13(15(16)21-20-14)10-5-4-6-17-8-10/h4-8H,3H2,1-2H3,(H3,16,20,21)
InChIKeyIHHFRNSFZRNSDK-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.38
Rot. Bonds3

About 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine

5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine (PubChem CID 104670730) has the molecular formula C15H16N6 and a molecular weight of 280.33 g/mol. Its IUPAC name is 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine
PubChem CID104670730
Molecular FormulaC15H16N6
Molecular Weight280.33 g/mol
Exact Mass280.14
IUPAC Name5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine
SMILESCCc1nnc(C)cc1-c1[nH]nc(N)c1-c1cccnc1
InChIInChI=1S/C15H16N6/c1-3-12-11(7-9(2)18-19-12)14-13(15(16)21-20-14)10-5-4-6-17-8-10/h4-8H,3H2,1-2H3,(H3,16,20,21)
InChIKeyIHHFRNSFZRNSDK-UHFFFAOYSA-N
XLogP2.38
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine (CID 104670730) is 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine is CCc1nnc(C)cc1-c1[nH]nc(N)c1-c1cccnc1.
What is the InChIKey of 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine?
The InChIKey is IHHFRNSFZRNSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6/c1-3-12-11(7-9(2)18-19-12)14-13(15(16)21-20-14)10-5-4-6-17-8-10/h4-8H,3H2,1-2H3,(H3,16,20,21).
What are the key properties of 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine?
5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine has a molecular weight of 280.33 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethyl-6-methylpyridazin-4-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 104670730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).