N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine

C13H16N6O2 — CID 133361416

IUPACN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOCCN(Cc1ccc(C)o1)c1ccc2nnnn2n1
InChIInChI=1S/C13H16N6O2/c1-10-3-4-11(21-10)9-18(7-8-20-2)13-6-5-12-14-16-17-19(12)15-13/h3-6H,7-9H2,1-2H3
InChIKeyCNNOUJFHBJHYKQ-UHFFFAOYSA-N
MW288.31 g/mol
LogP1.07
Rot. Bonds6

About N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine

N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 133361416) has the molecular formula C13H16N6O2 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID133361416
Molecular FormulaC13H16N6O2
Molecular Weight288.31 g/mol
Exact Mass288.13
IUPAC NameN-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESCOCCN(Cc1ccc(C)o1)c1ccc2nnnn2n1
InChIInChI=1S/C13H16N6O2/c1-10-3-4-11(21-10)9-18(7-8-20-2)13-6-5-12-14-16-17-19(12)15-13/h3-6H,7-9H2,1-2H3
InChIKeyCNNOUJFHBJHYKQ-UHFFFAOYSA-N
XLogP1.07
TPSA81.58 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine (CID 133361416) is N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine is COCCN(Cc1ccc(C)o1)c1ccc2nnnn2n1.
What is the InChIKey of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is CNNOUJFHBJHYKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O2/c1-10-3-4-11(21-10)9-18(7-8-20-2)13-6-5-12-14-16-17-19(12)15-13/h3-6H,7-9H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine?
N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 288.31 g/mol, XLogP of 1.07, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 133361416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).