4-(aminomethyl)-N-propylpyridazin-3-amine

C8H14N4 — CID 46848810

IUPAC4-(aminomethyl)-N-propylpyridazin-3-amine
SMILESCCCNc1nnccc1CN
InChIInChI=1S/C8H14N4/c1-2-4-10-8-7(6-9)3-5-11-12-8/h3,5H,2,4,6,9H2,1H3,(H,10,12)
InChIKeyMGZMZNZYDLKXCQ-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.76
Rot. Bonds4

About 4-(aminomethyl)-N-propylpyridazin-3-amine

4-(aminomethyl)-N-propylpyridazin-3-amine (PubChem CID 46848810) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 4-(aminomethyl)-N-propylpyridazin-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-propylpyridazin-3-amine
PubChem CID46848810
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name4-(aminomethyl)-N-propylpyridazin-3-amine
SMILESCCCNc1nnccc1CN
InChIInChI=1S/C8H14N4/c1-2-4-10-8-7(6-9)3-5-11-12-8/h3,5H,2,4,6,9H2,1H3,(H,10,12)
InChIKeyMGZMZNZYDLKXCQ-UHFFFAOYSA-N
XLogP0.76
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-propylpyridazin-3-amine?
The IUPAC name of 4-(aminomethyl)-N-propylpyridazin-3-amine (CID 46848810) is 4-(aminomethyl)-N-propylpyridazin-3-amine.
What is the SMILES notation for 4-(aminomethyl)-N-propylpyridazin-3-amine?
The canonical SMILES for 4-(aminomethyl)-N-propylpyridazin-3-amine is CCCNc1nnccc1CN.
What is the InChIKey of 4-(aminomethyl)-N-propylpyridazin-3-amine?
The InChIKey is MGZMZNZYDLKXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-2-4-10-8-7(6-9)3-5-11-12-8/h3,5H,2,4,6,9H2,1H3,(H,10,12).
What are the key properties of 4-(aminomethyl)-N-propylpyridazin-3-amine?
4-(aminomethyl)-N-propylpyridazin-3-amine has a molecular weight of 166.23 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-propylpyridazin-3-amine is sourced from PubChem (CID 46848810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).