N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine

C17H16N6O — CID 17452018

IUPACN-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
SMILESCOc1ccc2cc(CN(C)c3ccc4nnnn4n3)ccc2c1
InChIInChI=1S/C17H16N6O/c1-22(17-8-7-16-18-20-21-23(16)19-17)11-12-3-4-14-10-15(24-2)6-5-13(14)9-12/h3-10H,11H2,1-2H3
InChIKeyGTOFPGZNUQEMBN-UHFFFAOYSA-N
MW320.36 g/mol
LogP2.32
Rot. Bonds4

About N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine

N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 17452018) has the molecular formula C17H16N6O and a molecular weight of 320.36 g/mol. Its IUPAC name is N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
PubChem CID17452018
Molecular FormulaC17H16N6O
Molecular Weight320.36 g/mol
Exact Mass320.14
IUPAC NameN-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
SMILESCOc1ccc2cc(CN(C)c3ccc4nnnn4n3)ccc2c1
InChIInChI=1S/C17H16N6O/c1-22(17-8-7-16-18-20-21-23(16)19-17)11-12-3-4-14-10-15(24-2)6-5-13(14)9-12/h3-10H,11H2,1-2H3
InChIKeyGTOFPGZNUQEMBN-UHFFFAOYSA-N
XLogP2.32
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-N-[(3-propan-2-yloxyphenyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 133417071
ethane;1-(6-methoxynaphthalen-2-yl)-N,N-dimethylmethanamine
CID 142950158
1-hydroxy-1-[(6-methoxynaphthalen-2-yl)methyl]urea
CID 19780510
1-[methyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol
CID 47060282
3-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]-5-methyl-1,3,4-thiadiazole-2-thione
CID 9318489
4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide
CID 133384331
2-hydroxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
CID 115140024
4-(bromomethyl)-N-[(4-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 139548865
(6-methoxynaphthalen-2-yl)methanethiol
CID 79884829
N-(2-methoxyethyl)-N-[(5-methylfuran-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 133361416
7-bromo-2-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 17471416
2-[[(6-methoxynaphthalen-2-yl)methyl-methylamino]methyl]-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thione
CID 9318315

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine (CID 17452018) is N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine is COc1ccc2cc(CN(C)c3ccc4nnnn4n3)ccc2c1.
What is the InChIKey of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is GTOFPGZNUQEMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O/c1-22(17-8-7-16-18-20-21-23(16)19-17)11-12-3-4-14-10-15(24-2)6-5-13(14)9-12/h3-10H,11H2,1-2H3.
What are the key properties of N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine?
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 320.36 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 17452018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).