3-propylpyridazine

C7H10N2 — CID 19760644

IUPAC3-propylpyridazine
SMILESCCCc1cccnn1
InChIInChI=1S/C7H10N2/c1-2-4-7-5-3-6-8-9-7/h3,5-6H,2,4H2,1H3
InChIKeyDQFWXEPAERVANT-UHFFFAOYSA-N
MW122.17 g/mol
LogP1.43
Rot. Bonds2

About 3-propylpyridazine

3-propylpyridazine (PubChem CID 19760644) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 3-propylpyridazine.

Molecular Properties

Compound Name3-propylpyridazine
PubChem CID19760644
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name3-propylpyridazine
SMILESCCCc1cccnn1
InChIInChI=1S/C7H10N2/c1-2-4-7-5-3-6-8-9-7/h3,5-6H,2,4H2,1H3
InChIKeyDQFWXEPAERVANT-UHFFFAOYSA-N
XLogP1.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-propylpyridazine?
The IUPAC name of 3-propylpyridazine (CID 19760644) is 3-propylpyridazine.
What is the SMILES notation for 3-propylpyridazine?
The canonical SMILES for 3-propylpyridazine is CCCc1cccnn1.
What is the InChIKey of 3-propylpyridazine?
The InChIKey is DQFWXEPAERVANT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-2-4-7-5-3-6-8-9-7/h3,5-6H,2,4H2,1H3.
What are the key properties of 3-propylpyridazine?
3-propylpyridazine has a molecular weight of 122.17 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylpyridazine is sourced from PubChem (CID 19760644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).