5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine

C15H20N4 — CID 134546382

IUPAC5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine
SMILESCC(C)c1cnnc(CCC(C)c2ccnnc2)c1
InChIInChI=1S/C15H20N4/c1-11(2)14-8-15(19-18-10-14)5-4-12(3)13-6-7-16-17-9-13/h6-12H,4-5H2,1-3H3
InChIKeyZQDQSGHGXSUSKF-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.13
Rot. Bonds5

About 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine

5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine (PubChem CID 134546382) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine.

Molecular Properties

Compound Name5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine
PubChem CID134546382
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine
SMILESCC(C)c1cnnc(CCC(C)c2ccnnc2)c1
InChIInChI=1S/C15H20N4/c1-11(2)14-8-15(19-18-10-14)5-4-12(3)13-6-7-16-17-9-13/h6-12H,4-5H2,1-3H3
InChIKeyZQDQSGHGXSUSKF-UHFFFAOYSA-N
XLogP3.13
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methylbutyl)-4-propan-2-ylpyridine
CID 59202153
(1R)-1-pyridazin-4-ylethanamine
CID 86332876
3,5-di(propan-2-yl)pyridazine
CID 21037378
2-(9-pyridazin-4-yl-2-pyrimidin-5-yldecan-5-yl)pyrimidine
CID 135298526
2-propan-2-yl-4-[5-(5-propan-2-yl-3-pyridinyl)hexan-2-yl]pyridine
CID 155097626
2-[5-(6-ethylpyridazin-4-yl)hexan-2-yl]-4-fluoro-5-propan-2-yl-1,3-thiazole
CID 138548720
2-propan-2-yl-4-[5-(2-propan-2-yl-4-pyridinyl)hexan-2-yl]pyridine
CID 135215939
5-propan-2-yl-N-(2-propylpentyl)pyridazin-3-amine
CID 170099297
(2-methyl-1-pyridazin-4-ylpentyl)hydrazine
CID 107895929
3,5-bis(3-methylbutyl)pyridazine;3,4-bis(2-methylpropyl)pyridazine;3,5-bis(2-methylpropyl)pyridazine
CID 160691116
1-pyridazin-4-ylnonan-1-ol
CID 105085715
3-(4-propan-2-yl-2-pyridinyl)propan-1-amine
CID 115004203

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine?
The IUPAC name of 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine (CID 134546382) is 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine.
What is the SMILES notation for 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine?
The canonical SMILES for 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine is CC(C)c1cnnc(CCC(C)c2ccnnc2)c1.
What is the InChIKey of 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine?
The InChIKey is ZQDQSGHGXSUSKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11(2)14-8-15(19-18-10-14)5-4-12(3)13-6-7-16-17-9-13/h6-12H,4-5H2,1-3H3.
What are the key properties of 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine?
5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine has a molecular weight of 256.35 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-3-(3-pyridazin-4-ylbutyl)pyridazine is sourced from PubChem (CID 134546382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).