4-pentylpyridazin-3-amine

C9H15N3 — CID 69188714

IUPAC4-pentylpyridazin-3-amine
SMILESCCCCCc1ccnnc1N
InChIInChI=1S/C9H15N3/c1-2-3-4-5-8-6-7-11-12-9(8)10/h6-7H,2-5H2,1H3,(H2,10,12)
InChIKeyGHBHWYPWSAMEEF-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.79
Rot. Bonds4

About 4-pentylpyridazin-3-amine

4-pentylpyridazin-3-amine (PubChem CID 69188714) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 4-pentylpyridazin-3-amine.

Molecular Properties

Compound Name4-pentylpyridazin-3-amine
PubChem CID69188714
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name4-pentylpyridazin-3-amine
SMILESCCCCCc1ccnnc1N
InChIInChI=1S/C9H15N3/c1-2-3-4-5-8-6-7-11-12-9(8)10/h6-7H,2-5H2,1H3,(H2,10,12)
InChIKeyGHBHWYPWSAMEEF-UHFFFAOYSA-N
XLogP1.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-methyl-3-pentylpyridin-2-amine
CID 167157111
4,7-dihexyl-1,10-phenanthroline
CID 10904194
4,7-didodecyl-1,10-phenanthroline
CID 10098057
4,7-di(tridecyl)-1,10-phenanthroline
CID 5194028
3-methyl-4-propylpyridazine
CID 22419377
4-dodecyl-6-methylbenzene-1,3-diamine
CID 70404899
3-pentylpyridazine;piperazine
CID 69210510
4-heptyl-3-methylpyridine
CID 143666243
2-butyl-6-octylaniline
CID 154074002
2-tetradecylaniline
CID 22218918
methyl-(3-pentylpyridazin-4-yl)diazene
CID 123316923
4-octylpyridine-3-carbonitrile
CID 102497290

Frequently Asked Questions

What is the IUPAC name of 4-pentylpyridazin-3-amine?
The IUPAC name of 4-pentylpyridazin-3-amine (CID 69188714) is 4-pentylpyridazin-3-amine.
What is the SMILES notation for 4-pentylpyridazin-3-amine?
The canonical SMILES for 4-pentylpyridazin-3-amine is CCCCCc1ccnnc1N.
What is the InChIKey of 4-pentylpyridazin-3-amine?
The InChIKey is GHBHWYPWSAMEEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-3-4-5-8-6-7-11-12-9(8)10/h6-7H,2-5H2,1H3,(H2,10,12).
What are the key properties of 4-pentylpyridazin-3-amine?
4-pentylpyridazin-3-amine has a molecular weight of 165.24 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pentylpyridazin-3-amine is sourced from PubChem (CID 69188714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).