[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine

C9H11N5 — CID 82404489

IUPAC[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine
SMILESCn1cc(-c2cnncc2CN)cn1
InChIInChI=1S/C9H11N5/c1-14-6-8(4-13-14)9-5-12-11-3-7(9)2-10/h3-6H,2,10H2,1H3
InChIKeyWUOROPGGENQHHI-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.34
Rot. Bonds2

About [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine

[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine (PubChem CID 82404489) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine
PubChem CID82404489
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine
SMILESCn1cc(-c2cnncc2CN)cn1
InChIInChI=1S/C9H11N5/c1-14-6-8(4-13-14)9-5-12-11-3-7(9)2-10/h3-6H,2,10H2,1H3
InChIKeyWUOROPGGENQHHI-UHFFFAOYSA-N
XLogP0.34
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-methyl-3-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 171364559
[4,5-dimethoxy-2-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 54980067
[4-methyl-3-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 105408567
[5-(2-methylpyrazol-3-yl)pyridazin-4-yl]methanamine
CID 82404490
3,4-dimethyl-5-(1-methylpyrazol-4-yl)aniline
CID 165495050
2,5-dimethyl-3-(1-methylpyrazol-4-yl)aniline
CID 165494673
[3-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 61033657
[6-methyl-2-(1-methylpyrazol-4-yl)pyrimidin-4-yl]methanamine
CID 65197998
1-methyl-4-naphthalen-1-ylpyrazole
CID 97034296
1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
[2-(1-methylpyrazol-4-yl)phenyl]phosphane
CID 166648081
[5-chloro-6-(1-methylpyrazol-4-yl)-3-pyridinyl]methanamine
CID 121209283

Frequently Asked Questions

What is the IUPAC name of [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine?
The IUPAC name of [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine (CID 82404489) is [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine.
What is the SMILES notation for [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine?
The canonical SMILES for [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine is Cn1cc(-c2cnncc2CN)cn1.
What is the InChIKey of [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine?
The InChIKey is WUOROPGGENQHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-14-6-8(4-13-14)9-5-12-11-3-7(9)2-10/h3-6H,2,10H2,1H3.
What are the key properties of [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine?
[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine has a molecular weight of 189.22 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine is sourced from PubChem (CID 82404489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).