6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine

C17H17N7 — CID 134036776

IUPAC6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
SMILESc1ccc2c(C3CCN(c4ccc5nnnn5n4)CC3)c[nH]c2c1
InChIInChI=1S/C17H17N7/c1-2-4-15-13(3-1)14(11-18-15)12-7-9-23(10-8-12)17-6-5-16-19-21-22-24(16)20-17/h1-6,11-12,18H,7-10H2
InChIKeyYERDDKMWYBQDQP-UHFFFAOYSA-N
MW319.37 g/mol
LogP2.38
Rot. Bonds2

About 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine

6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine (PubChem CID 134036776) has the molecular formula C17H17N7 and a molecular weight of 319.37 g/mol. Its IUPAC name is 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine.

Molecular Properties

Compound Name6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
PubChem CID134036776
Molecular FormulaC17H17N7
Molecular Weight319.37 g/mol
Exact Mass319.15
IUPAC Name6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
SMILESc1ccc2c(C3CCN(c4ccc5nnnn5n4)CC3)c[nH]c2c1
InChIInChI=1S/C17H17N7/c1-2-4-15-13(3-1)14(11-18-15)12-7-9-23(10-8-12)17-6-5-16-19-21-22-24(16)20-17/h1-6,11-12,18H,7-10H2
InChIKeyYERDDKMWYBQDQP-UHFFFAOYSA-N
XLogP2.38
TPSA75.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[4-(1H-indol-3-yl)piperidin-1-yl]-N-phenylpyridazine-3-carboxamide
CID 133313623
6-(4-phenylazepan-1-yl)tetrazolo[1,5-b]pyridazine
CID 133286661
3-[1-(2-methylphenyl)piperidin-4-yl]-1H-indole
CID 91802123
6-(4-phenylpiperazin-1-yl)tetrazolo[1,5-b]pyridazine
CID 685555
3-(1-methylpiperidin-4-yl)-1H-indole;dihydrochloride
CID 174560357
ethane;4-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]benzonitrile
CID 177329248
3-(4-methylquinolin-2-yl)-5-[1-(tetrazolo[1,5-b]pyridazin-6-yl)piperidin-4-yl]-1,2,4-oxadiazole
CID 167874479
2-[4-(1H-indol-3-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 134036774
3-(1-methylpyrrolidin-3-yl)-1H-indole
CID 19337
2-[4-(1H-indol-3-yl)piperidin-1-yl]ethanethiol
CID 116997210
5-fluoro-4-[4-(1H-indol-3-yl)piperidin-1-yl]quinazoline
CID 55853938
6-[4-(1H-indol-3-yl)piperidin-1-yl]-7,8-dimethyl-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 133367858

Frequently Asked Questions

What is the IUPAC name of 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine?
The IUPAC name of 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine (CID 134036776) is 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine.
What is the SMILES notation for 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine?
The canonical SMILES for 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine is c1ccc2c(C3CCN(c4ccc5nnnn5n4)CC3)c[nH]c2c1.
What is the InChIKey of 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine?
The InChIKey is YERDDKMWYBQDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7/c1-2-4-15-13(3-1)14(11-18-15)12-7-9-23(10-8-12)17-6-5-16-19-21-22-24(16)20-17/h1-6,11-12,18H,7-10H2.
What are the key properties of 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine?
6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine has a molecular weight of 319.37 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(1H-indol-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine is sourced from PubChem (CID 134036776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).