N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine

C17H21N3O — CID 654107

IUPACN-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine
SMILESCOc1ccccc1-c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C17H21N3O/c1-21-16-10-6-5-9-14(16)15-11-12-17(20-19-15)18-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,18,20)
InChIKeyJOUUGXXLGXOFKS-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.90
Rot. Bonds4

About N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine

N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine (PubChem CID 654107) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine
PubChem CID654107
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine
SMILESCOc1ccccc1-c1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C17H21N3O/c1-21-16-10-6-5-9-14(16)15-11-12-17(20-19-15)18-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,18,20)
InChIKeyJOUUGXXLGXOFKS-UHFFFAOYSA-N
XLogP3.90
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine?
The IUPAC name of N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine (CID 654107) is N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine.
What is the SMILES notation for N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine?
The canonical SMILES for N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine is COc1ccccc1-c1ccc(NC2CCCCC2)nn1.
What is the InChIKey of N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine?
The InChIKey is JOUUGXXLGXOFKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-21-16-10-6-5-9-14(16)15-11-12-17(20-19-15)18-13-7-3-2-4-8-13/h5-6,9-13H,2-4,7-8H2,1H3,(H,18,20).
What are the key properties of N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine?
N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine has a molecular weight of 283.38 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(2-methoxyphenyl)pyridazin-3-amine is sourced from PubChem (CID 654107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).