4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine

C10H12N4 — CID 103341793

IUPAC4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine
SMILESCc1c(N)nnc(-c2ccc[nH]2)c1C
InChIInChI=1S/C10H12N4/c1-6-7(2)10(11)14-13-9(6)8-4-3-5-12-8/h3-5,12H,1-2H3,(H2,11,14)
InChIKeyRAHDLFVYICOJMS-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.67
Rot. Bonds1

About 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine

4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine (PubChem CID 103341793) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine
PubChem CID103341793
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine
SMILESCc1c(N)nnc(-c2ccc[nH]2)c1C
InChIInChI=1S/C10H12N4/c1-6-7(2)10(11)14-13-9(6)8-4-3-5-12-8/h3-5,12H,1-2H3,(H2,11,14)
InChIKeyRAHDLFVYICOJMS-UHFFFAOYSA-N
XLogP1.67
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine?
The IUPAC name of 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine (CID 103341793) is 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine.
What is the SMILES notation for 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine?
The canonical SMILES for 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine is Cc1c(N)nnc(-c2ccc[nH]2)c1C.
What is the InChIKey of 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine?
The InChIKey is RAHDLFVYICOJMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-6-7(2)10(11)14-13-9(6)8-4-3-5-12-8/h3-5,12H,1-2H3,(H2,11,14).
What are the key properties of 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine?
4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine has a molecular weight of 188.23 g/mol, XLogP of 1.67, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-6-(1H-pyrrol-2-yl)pyridazin-3-amine is sourced from PubChem (CID 103341793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).