N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine

C8H12N6O — CID 102699023

IUPACN-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOC(C)CNc1ccc2nnnn2n1
InChIInChI=1S/C8H12N6O/c1-6(15-2)5-9-7-3-4-8-10-12-13-14(8)11-7/h3-4,6H,5H2,1-2H3,(H,9,11)
InChIKeyCKTSFKQXRZGWOK-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.03
Rot. Bonds4

About N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine

N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 102699023) has the molecular formula C8H12N6O and a molecular weight of 208.22 g/mol. Its IUPAC name is N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID102699023
Molecular FormulaC8H12N6O
Molecular Weight208.22 g/mol
Exact Mass208.11
IUPAC NameN-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOC(C)CNc1ccc2nnnn2n1
InChIInChI=1S/C8H12N6O/c1-6(15-2)5-9-7-3-4-8-10-12-13-14(8)11-7/h3-4,6H,5H2,1-2H3,(H,9,11)
InChIKeyCKTSFKQXRZGWOK-UHFFFAOYSA-N
XLogP-0.03
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-methyl-3-methylsulfanylpropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 78957763
N-[3-(3,4-dimethoxyphenyl)-2-methylpropyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 133431135
N-(2-pyrrolidin-1-ylpropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 113222142
(2S)-2-N,2-N-diethyl-4-methyl-1-N-(tetrazolo[1,5-b]pyridazin-6-yl)pentane-1,2-diamine
CID 25469022
(1R)-N,N-dimethyl-1-phenyl-N'-(tetrazolo[1,5-b]pyridazin-6-yl)ethane-1,2-diamine
CID 40843444
2,2-dimethyl-N'-(tetrazolo[1,5-b]pyridazin-6-yl)propane-1,3-diamine
CID 115366197
N-(1-methoxy-2-methylpropan-2-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 115606699
N-(2,2-dimethylbutyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 103462537
N-[(1-methylcyclopropyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 103725068
N-[(1-methoxycyclobutyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 113362466
(1S)-1-cyclohexyl-N,N-dimethyl-N'-(tetrazolo[1,5-b]pyridazin-6-yl)ethane-1,2-diamine
CID 94063941
N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 92813665

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine (CID 102699023) is N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine is COC(C)CNc1ccc2nnnn2n1.
What is the InChIKey of N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is CKTSFKQXRZGWOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N6O/c1-6(15-2)5-9-7-3-4-8-10-12-13-14(8)11-7/h3-4,6H,5H2,1-2H3,(H,9,11).
What are the key properties of N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine?
N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 208.22 g/mol, XLogP of -0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 102699023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).