6-cyclopropyl-N,4-dimethylpyridazin-3-amine

C9H13N3 — CID 163369234

IUPAC6-cyclopropyl-N,4-dimethylpyridazin-3-amine
SMILESCNc1nnc(C2CC2)cc1C
InChIInChI=1S/C9H13N3/c1-6-5-8(7-3-4-7)11-12-9(6)10-2/h5,7H,3-4H2,1-2H3,(H,10,12)
InChIKeyUPUDKUYGJWHLSN-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.70
Rot. Bonds2

About 6-cyclopropyl-N,4-dimethylpyridazin-3-amine

6-cyclopropyl-N,4-dimethylpyridazin-3-amine (PubChem CID 163369234) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 6-cyclopropyl-N,4-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-cyclopropyl-N,4-dimethylpyridazin-3-amine
PubChem CID163369234
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name6-cyclopropyl-N,4-dimethylpyridazin-3-amine
SMILESCNc1nnc(C2CC2)cc1C
InChIInChI=1S/C9H13N3/c1-6-5-8(7-3-4-7)11-12-9(6)10-2/h5,7H,3-4H2,1-2H3,(H,10,12)
InChIKeyUPUDKUYGJWHLSN-UHFFFAOYSA-N
XLogP1.70
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N,4-dimethylpyridazin-3-amine?
The IUPAC name of 6-cyclopropyl-N,4-dimethylpyridazin-3-amine (CID 163369234) is 6-cyclopropyl-N,4-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-cyclopropyl-N,4-dimethylpyridazin-3-amine?
The canonical SMILES for 6-cyclopropyl-N,4-dimethylpyridazin-3-amine is CNc1nnc(C2CC2)cc1C.
What is the InChIKey of 6-cyclopropyl-N,4-dimethylpyridazin-3-amine?
The InChIKey is UPUDKUYGJWHLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c1-6-5-8(7-3-4-7)11-12-9(6)10-2/h5,7H,3-4H2,1-2H3,(H,10,12).
What are the key properties of 6-cyclopropyl-N,4-dimethylpyridazin-3-amine?
6-cyclopropyl-N,4-dimethylpyridazin-3-amine has a molecular weight of 163.22 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N,4-dimethylpyridazin-3-amine is sourced from PubChem (CID 163369234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).