6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine

C10H13N5 — CID 112710709

IUPAC6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine
SMILESc1cc2[nH]c(C3CCCNC3)nc2nn1
InChIInChI=1S/C10H13N5/c1-2-7(6-11-4-1)9-13-8-3-5-12-15-10(8)14-9/h3,5,7,11H,1-2,4,6H2,(H,13,14,15)
InChIKeyWGXLSGKCEMVHLI-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.82
Rot. Bonds1

About 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine

6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine (PubChem CID 112710709) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine.

Molecular Properties

Compound Name6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine
PubChem CID112710709
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine
SMILESc1cc2[nH]c(C3CCCNC3)nc2nn1
InChIInChI=1S/C10H13N5/c1-2-7(6-11-4-1)9-13-8-3-5-12-15-10(8)14-9/h3,5,7,11H,1-2,4,6H2,(H,13,14,15)
InChIKeyWGXLSGKCEMVHLI-UHFFFAOYSA-N
XLogP0.82
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-2-piperidin-3-yl-1H-imidazo[4,5-b]pyridine
CID 65483260
2-[(3S)-piperidin-3-yl]-1H-benzimidazole;dihydrochloride
CID 131870823
2-piperidin-3-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 115018775
2-piperidin-3-yl-3H-benzimidazole-5-carboxylic acid
CID 83424440
3-(4,5-dimethyl-1H-imidazol-2-yl)piperidine
CID 43650978
6-ethoxy-2-piperidin-3-yl-1H-benzimidazole
CID 82331880
3-(1H-imidazol-2-yl)piperidine
CID 13281195
3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
CID 105492309
2-[(2-piperidin-3-yl-3H-benzimidazol-5-yl)oxy]ethanethioamide
CID 84816446
6-(piperazin-1-ylmethyl)-2-piperidin-3-yl-1H-benzimidazole
CID 83949259
4-piperidin-3-ylpyridine;dihydrochloride
CID 91809614
3-[(2-piperidin-3-yl-3H-benzimidazol-5-yl)oxy]propan-1-ol
CID 84816442

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine?
The IUPAC name of 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine (CID 112710709) is 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine.
What is the SMILES notation for 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine?
The canonical SMILES for 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine is c1cc2[nH]c(C3CCCNC3)nc2nn1.
What is the InChIKey of 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine?
The InChIKey is WGXLSGKCEMVHLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-2-7(6-11-4-1)9-13-8-3-5-12-15-10(8)14-9/h3,5,7,11H,1-2,4,6H2,(H,13,14,15).
What are the key properties of 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine?
6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine has a molecular weight of 203.25 g/mol, XLogP of 0.82, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine is sourced from PubChem (CID 112710709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).