6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine

C15H17N3O — CID 167138148

IUPAC6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine
SMILESCOc1ccc2c(c1-c1nnc(N)cc1C)CCC2
InChIInChI=1S/C15H17N3O/c1-9-8-13(16)17-18-15(9)14-11-5-3-4-10(11)6-7-12(14)19-2/h6-8H,3-5H2,1-2H3,(H2,16,17)
InChIKeyRQOWCZZZAATJOB-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.53
Rot. Bonds2

About 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine

6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine (PubChem CID 167138148) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine
PubChem CID167138148
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine
SMILESCOc1ccc2c(c1-c1nnc(N)cc1C)CCC2
InChIInChI=1S/C15H17N3O/c1-9-8-13(16)17-18-15(9)14-11-5-3-4-10(11)6-7-12(14)19-2/h6-8H,3-5H2,1-2H3,(H2,16,17)
InChIKeyRQOWCZZZAATJOB-UHFFFAOYSA-N
XLogP2.53
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine?
The IUPAC name of 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine (CID 167138148) is 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine.
What is the SMILES notation for 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine?
The canonical SMILES for 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine is COc1ccc2c(c1-c1nnc(N)cc1C)CCC2.
What is the InChIKey of 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine?
The InChIKey is RQOWCZZZAATJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-9-8-13(16)17-18-15(9)14-11-5-3-4-10(11)6-7-12(14)19-2/h6-8H,3-5H2,1-2H3,(H2,16,17).
What are the key properties of 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine?
6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine has a molecular weight of 255.32 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methoxy-2,3-dihydro-1H-inden-4-yl)-5-methylpyridazin-3-amine is sourced from PubChem (CID 167138148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).