N-(2-methylpropyl)pyridazin-3-amine

C8H13N3 — CID 62482226

IUPACN-(2-methylpropyl)pyridazin-3-amine
SMILESCC(C)CNc1cccnn1
InChIInChI=1S/C8H13N3/c1-7(2)6-9-8-4-3-5-10-11-8/h3-5,7H,6H2,1-2H3,(H,9,11)
InChIKeyKTFDUDXMLAYFGL-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.54
Rot. Bonds3

About N-(2-methylpropyl)pyridazin-3-amine

N-(2-methylpropyl)pyridazin-3-amine (PubChem CID 62482226) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is N-(2-methylpropyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)pyridazin-3-amine
PubChem CID62482226
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC NameN-(2-methylpropyl)pyridazin-3-amine
SMILESCC(C)CNc1cccnn1
InChIInChI=1S/C8H13N3/c1-7(2)6-9-8-4-3-5-10-11-8/h3-5,7H,6H2,1-2H3,(H,9,11)
InChIKeyKTFDUDXMLAYFGL-UHFFFAOYSA-N
XLogP1.54
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)pyridazin-3-amine?
The IUPAC name of N-(2-methylpropyl)pyridazin-3-amine (CID 62482226) is N-(2-methylpropyl)pyridazin-3-amine.
What is the SMILES notation for N-(2-methylpropyl)pyridazin-3-amine?
The canonical SMILES for N-(2-methylpropyl)pyridazin-3-amine is CC(C)CNc1cccnn1.
What is the InChIKey of N-(2-methylpropyl)pyridazin-3-amine?
The InChIKey is KTFDUDXMLAYFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-7(2)6-9-8-4-3-5-10-11-8/h3-5,7H,6H2,1-2H3,(H,9,11).
What are the key properties of N-(2-methylpropyl)pyridazin-3-amine?
N-(2-methylpropyl)pyridazin-3-amine has a molecular weight of 151.21 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)pyridazin-3-amine is sourced from PubChem (CID 62482226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).