6-propan-2-ylpyridazin-3-amine

C7H11N3 — CID 23028109

IUPAC6-propan-2-ylpyridazin-3-amine
SMILESCC(C)c1ccc(N)nn1
InChIInChI=1S/C7H11N3/c1-5(2)6-3-4-7(8)10-9-6/h3-5H,1-2H3,(H2,8,10)
InChIKeyQRQPUOPWIKVDOK-UHFFFAOYSA-N
MW137.19 g/mol
LogP1.18
Rot. Bonds1

About 6-propan-2-ylpyridazin-3-amine

6-propan-2-ylpyridazin-3-amine (PubChem CID 23028109) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 6-propan-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-propan-2-ylpyridazin-3-amine
PubChem CID23028109
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name6-propan-2-ylpyridazin-3-amine
SMILESCC(C)c1ccc(N)nn1
InChIInChI=1S/C7H11N3/c1-5(2)6-3-4-7(8)10-9-6/h3-5H,1-2H3,(H2,8,10)
InChIKeyQRQPUOPWIKVDOK-UHFFFAOYSA-N
XLogP1.18
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylpyridazin-3-amine?
The IUPAC name of 6-propan-2-ylpyridazin-3-amine (CID 23028109) is 6-propan-2-ylpyridazin-3-amine.
What is the SMILES notation for 6-propan-2-ylpyridazin-3-amine?
The canonical SMILES for 6-propan-2-ylpyridazin-3-amine is CC(C)c1ccc(N)nn1.
What is the InChIKey of 6-propan-2-ylpyridazin-3-amine?
The InChIKey is QRQPUOPWIKVDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-5(2)6-3-4-7(8)10-9-6/h3-5H,1-2H3,(H2,8,10).
What are the key properties of 6-propan-2-ylpyridazin-3-amine?
6-propan-2-ylpyridazin-3-amine has a molecular weight of 137.19 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylpyridazin-3-amine is sourced from PubChem (CID 23028109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).