3-(dipropylamino)-1H-pyridazin-6-one

C10H17N3O — CID 71409624

IUPAC3-(dipropylamino)-1H-pyridazin-6-one
SMILESCCCN(CCC)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H17N3O/c1-3-7-13(8-4-2)9-5-6-10(14)12-11-9/h5-6H,3-4,7-8H2,1-2H3,(H,12,14)
InChIKeyKRRQYPWJCMSHMC-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.40
Rot. Bonds5

About 3-(dipropylamino)-1H-pyridazin-6-one

3-(dipropylamino)-1H-pyridazin-6-one (PubChem CID 71409624) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-(dipropylamino)-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-(dipropylamino)-1H-pyridazin-6-one
PubChem CID71409624
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name3-(dipropylamino)-1H-pyridazin-6-one
SMILESCCCN(CCC)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H17N3O/c1-3-7-13(8-4-2)9-5-6-10(14)12-11-9/h5-6H,3-4,7-8H2,1-2H3,(H,12,14)
InChIKeyKRRQYPWJCMSHMC-UHFFFAOYSA-N
XLogP1.40
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(dipropylamino)-1H-pyridazin-6-one?
The IUPAC name of 3-(dipropylamino)-1H-pyridazin-6-one (CID 71409624) is 3-(dipropylamino)-1H-pyridazin-6-one.
What is the SMILES notation for 3-(dipropylamino)-1H-pyridazin-6-one?
The canonical SMILES for 3-(dipropylamino)-1H-pyridazin-6-one is CCCN(CCC)c1ccc(=O)[nH]n1.
What is the InChIKey of 3-(dipropylamino)-1H-pyridazin-6-one?
The InChIKey is KRRQYPWJCMSHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-7-13(8-4-2)9-5-6-10(14)12-11-9/h5-6H,3-4,7-8H2,1-2H3,(H,12,14).
What are the key properties of 3-(dipropylamino)-1H-pyridazin-6-one?
3-(dipropylamino)-1H-pyridazin-6-one has a molecular weight of 195.27 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dipropylamino)-1H-pyridazin-6-one is sourced from PubChem (CID 71409624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).