N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine

C12H17N5 — CID 62202694

IUPACN-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine
SMILESCCNc1ccc(-c2c(C)nn(C)c2C)nn1
InChIInChI=1S/C12H17N5/c1-5-13-11-7-6-10(14-15-11)12-8(2)16-17(4)9(12)3/h6-7H,5H2,1-4H3,(H,13,15)
InChIKeyZPOZGMYMUPUZFM-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.93
Rot. Bonds3

About N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine

N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine (PubChem CID 62202694) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine
PubChem CID62202694
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC NameN-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine
SMILESCCNc1ccc(-c2c(C)nn(C)c2C)nn1
InChIInChI=1S/C12H17N5/c1-5-13-11-7-6-10(14-15-11)12-8(2)16-17(4)9(12)3/h6-7H,5H2,1-4H3,(H,13,15)
InChIKeyZPOZGMYMUPUZFM-UHFFFAOYSA-N
XLogP1.93
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-3-methyl-1H-pyrazol-5-amine
CID 769146
1-Methyl-3-phenyl-1H-pyrazol-5-amine
CID 517779
1-benzyl-3-phenyl-1H-pyrazol-5-amine
CID 684746
N-benzyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 743063
N'-benzyl-N'-methyl-N-(6-phenylpyridazin-3-yl)pentane-1,5-diamine
CID 10713570
5-Amino-1-benzyl-3-methyl-1H-pyrazole-4-carbonitrile
CID 683821
N-methyl-5-phenyl-1H-pyrazol-3-amine
CID 12356179
3-(4-Fluorophenyl)-1-methyl-1H-pyrazol-5-amine
CID 6483872
N-[2-(2-cyanoethyl)-5-methyl-3-pyrazolyl]-N''-methylbenzenecarboximidamide
CID 2324502
N,N-Dimethyl-N''-(4-methyl-6-phenyl-pyridazin-3-yl)-ethane-1,2-diamine
CID 6410805
N,N-Diethyl-N''-(4-methyl-6-phenyl-pyridazin-3-yl)-ethane-1,2-diamine
CID 6410807
N'-benzyl-N'-methyl-N-(6-phenylpyridazin-3-yl)pentane-1,5-diamine;hydrochloride
CID 45265420

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine?
The IUPAC name of N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine (CID 62202694) is N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine.
What is the SMILES notation for N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine?
The canonical SMILES for N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine is CCNc1ccc(-c2c(C)nn(C)c2C)nn1.
What is the InChIKey of N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine?
The InChIKey is ZPOZGMYMUPUZFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-5-13-11-7-6-10(14-15-11)12-8(2)16-17(4)9(12)3/h6-7H,5H2,1-4H3,(H,13,15).
What are the key properties of N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine?
N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine has a molecular weight of 231.30 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(1,3,5-trimethylpyrazol-4-yl)pyridazin-3-amine is sourced from PubChem (CID 62202694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).