1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine

C8H12N4 — CID 106550107

IUPAC1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine
SMILESCc1cnnc(NC2CC2N)c1
InChIInChI=1S/C8H12N4/c1-5-2-8(12-10-4-5)11-7-3-6(7)9/h2,4,6-7H,3,9H2,1H3,(H,11,12)
InChIKeyWMHFACWUZZCAAG-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.30
Rot. Bonds2

About 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine

1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine (PubChem CID 106550107) has the molecular formula C8H12N4 and a molecular weight of 164.21 g/mol. Its IUPAC name is 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine
PubChem CID106550107
Molecular FormulaC8H12N4
Molecular Weight164.21 g/mol
Exact Mass164.11
IUPAC Name1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine
SMILESCc1cnnc(NC2CC2N)c1
InChIInChI=1S/C8H12N4/c1-5-2-8(12-10-4-5)11-7-3-6(7)9/h2,4,6-7H,3,9H2,1H3,(H,11,12)
InChIKeyWMHFACWUZZCAAG-UHFFFAOYSA-N
XLogP0.30
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine?
The IUPAC name of 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine (CID 106550107) is 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine.
What is the SMILES notation for 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine?
The canonical SMILES for 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine is Cc1cnnc(NC2CC2N)c1.
What is the InChIKey of 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine?
The InChIKey is WMHFACWUZZCAAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4/c1-5-2-8(12-10-4-5)11-7-3-6(7)9/h2,4,6-7H,3,9H2,1H3,(H,11,12).
What are the key properties of 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine?
1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine has a molecular weight of 164.21 g/mol, XLogP of 0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(5-methylpyridazin-3-yl)cyclopropane-1,2-diamine is sourced from PubChem (CID 106550107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).