N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine

C10H14N6O — CID 113362466

IUPACN-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOC1(CNc2ccc3nnnn3n2)CCC1
InChIInChI=1S/C10H14N6O/c1-17-10(5-2-6-10)7-11-8-3-4-9-12-14-15-16(9)13-8/h3-4H,2,5-7H2,1H3,(H,11,13)
InChIKeyQOXGHHKAARNRQL-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.50
Rot. Bonds4

About N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine

N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 113362466) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID113362466
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC NameN-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOC1(CNc2ccc3nnnn3n2)CCC1
InChIInChI=1S/C10H14N6O/c1-17-10(5-2-6-10)7-11-8-3-4-9-12-14-15-16(9)13-8/h3-4H,2,5-7H2,1H3,(H,11,13)
InChIKeyQOXGHHKAARNRQL-UHFFFAOYSA-N
XLogP0.50
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(1-methylcyclopropyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 103725068
1-[(tetrazolo[1,5-b]pyridazin-6-ylamino)methyl]cyclobutan-1-ol
CID 115620433
N-[(1-ethylcyclopentyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 113257468
1-[(tetrazolo[1,5-b]pyridazin-6-ylamino)methyl]cycloheptan-1-ol
CID 78993011
1-[(tetrazolo[1,5-b]pyridazin-6-ylamino)methyl]cyclohexan-1-ol
CID 78990679
N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 102699023
N-[[1-(4-fluorophenyl)cyclohexyl]methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 47070615
N-(2-methyl-3-methylsulfanylpropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 78957763
N-(1-methoxy-2-methylpropan-2-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 115606699
N-[(1-methoxycyclobutyl)methyl]-6-(3-methylpyrazol-1-yl)pyridazin-3-amine
CID 133459940
N-(2,2-dimethylbutyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 103462537
N-(2-pyrrolidin-1-ylpropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 113222142

Frequently Asked Questions

What is the IUPAC name of N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine (CID 113362466) is N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine is COC1(CNc2ccc3nnnn3n2)CCC1.
What is the InChIKey of N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is QOXGHHKAARNRQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-17-10(5-2-6-10)7-11-8-3-4-9-12-14-15-16(9)13-8/h3-4H,2,5-7H2,1H3,(H,11,13).
What are the key properties of N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 234.26 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 113362466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).