[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine

C15H16N4 — CID 82382236

IUPAC[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine
SMILESCc1cc2cccc(C)n2c1-c1cnncc1CN
InChIInChI=1S/C15H16N4/c1-10-6-13-5-3-4-11(2)19(13)15(10)14-9-18-17-8-12(14)7-16/h3-6,8-9H,7,16H2,1-2H3
InChIKeyYAYSAPURSLLJIA-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.47
Rot. Bonds2

About [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine

[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine (PubChem CID 82382236) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine
PubChem CID82382236
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine
SMILESCc1cc2cccc(C)n2c1-c1cnncc1CN
InChIInChI=1S/C15H16N4/c1-10-6-13-5-3-4-11(2)19(13)15(10)14-9-18-17-8-12(14)7-16/h3-6,8-9H,7,16H2,1-2H3
InChIKeyYAYSAPURSLLJIA-UHFFFAOYSA-N
XLogP2.47
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(aminomethyl)-6-methylquinolizin-4-one
CID 115017540
[2-methyl-5-(5-methylindolizin-3-yl)-1H-pyrrol-3-yl]methanamine
CID 82388268
[3-(2-methylphenyl)indolizin-2-yl]methanamine
CID 118573394
[5-(2-methylpyrazol-3-yl)pyridazin-4-yl]methanamine
CID 82404490
(7-methylpyrazolo[1,5-a]pyridin-2-yl)methanamine
CID 83826625
[5-(3-methyl-1H-indol-5-yl)pyridazin-4-yl]methanamine
CID 82388683
2-(5-methylimidazo[1,5-a]pyridin-3-yl)acetic acid
CID 83829431
[5-(1-methylpyrazol-4-yl)pyridazin-4-yl]methanamine
CID 82404489
[6-(5-methylindolizin-3-yl)pyrazin-2-yl]methanamine
CID 82388723
[3-methyl-2-(1,2,4-triazol-4-yl)phenyl]methanamine
CID 82504473
[5-(3-methyl-2H-thieno[2,3-c]pyrazol-5-yl)pyridazin-4-yl]methanamine
CID 82384961
(6-methyl-4-phenyl-3-pyridinyl)methanamine
CID 90247119

Frequently Asked Questions

What is the IUPAC name of [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine?
The IUPAC name of [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine (CID 82382236) is [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine.
What is the SMILES notation for [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine?
The canonical SMILES for [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine is Cc1cc2cccc(C)n2c1-c1cnncc1CN.
What is the InChIKey of [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine?
The InChIKey is YAYSAPURSLLJIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-10-6-13-5-3-4-11(2)19(13)15(10)14-9-18-17-8-12(14)7-16/h3-6,8-9H,7,16H2,1-2H3.
What are the key properties of [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine?
[5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine has a molecular weight of 252.32 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,5-dimethylindolizin-3-yl)pyridazin-4-yl]methanamine is sourced from PubChem (CID 82382236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).