5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine

C11H18N4 — CID 130267575

IUPAC5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine
SMILESCC(C)c1cnnc(NC2CCNC2)c1
InChIInChI=1S/C11H18N4/c1-8(2)9-5-11(15-13-6-9)14-10-3-4-12-7-10/h5-6,8,10,12H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyLQCNJAOASFKOCY-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.37
Rot. Bonds3

About 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine

5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine (PubChem CID 130267575) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine.

Molecular Properties

Compound Name5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine
PubChem CID130267575
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine
SMILESCC(C)c1cnnc(NC2CCNC2)c1
InChIInChI=1S/C11H18N4/c1-8(2)9-5-11(15-13-6-9)14-10-3-4-12-7-10/h5-6,8,10,12H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyLQCNJAOASFKOCY-UHFFFAOYSA-N
XLogP1.37
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine?
The IUPAC name of 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine (CID 130267575) is 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine.
What is the SMILES notation for 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine?
The canonical SMILES for 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine is CC(C)c1cnnc(NC2CCNC2)c1.
What is the InChIKey of 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine?
The InChIKey is LQCNJAOASFKOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-8(2)9-5-11(15-13-6-9)14-10-3-4-12-7-10/h5-6,8,10,12H,3-4,7H2,1-2H3,(H,14,15).
What are the key properties of 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine?
5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-N-pyrrolidin-3-ylpyridazin-3-amine is sourced from PubChem (CID 130267575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).