N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine

C17H20N6 — CID 133431707

IUPACN-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC(C)c1ccc2c(c1)[C@H](Nc1ccc3nnnn3n1)CCC2
InChIInChI=1S/C17H20N6/c1-11(2)13-7-6-12-4-3-5-15(14(12)10-13)18-16-8-9-17-19-21-22-23(17)20-16/h6-11,15H,3-5H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyCXKFJMAFJQHAOF-OAHLLOKOSA-N
MW308.39 g/mol
LogP3.13
Rot. Bonds3

About N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine

N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 133431707) has the molecular formula C17H20N6 and a molecular weight of 308.39 g/mol. Its IUPAC name is N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID133431707
Molecular FormulaC17H20N6
Molecular Weight308.39 g/mol
Exact Mass308.17
IUPAC NameN-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCC(C)c1ccc2c(c1)[C@H](Nc1ccc3nnnn3n1)CCC2
InChIInChI=1S/C17H20N6/c1-11(2)13-7-6-12-4-3-5-15(14(12)10-13)18-16-8-9-17-19-21-22-23(17)20-16/h6-11,15H,3-5H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyCXKFJMAFJQHAOF-OAHLLOKOSA-N
XLogP3.13
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine (CID 133431707) is N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine is CC(C)c1ccc2c(c1)[C@H](Nc1ccc3nnnn3n1)CCC2.
What is the InChIKey of N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is CXKFJMAFJQHAOF-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H20N6/c1-11(2)13-7-6-12-4-3-5-15(14(12)10-13)18-16-8-9-17-19-21-22-23(17)20-16/h6-11,15H,3-5H2,1-2H3,(H,18,20)/t15-/m1/s1.
What are the key properties of N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine?
N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 308.39 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl]tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 133431707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).