6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine

C13H15N3O2 — CID 96662586

IUPAC6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine
SMILESCOCCOc1ccc(-c2ccc(N)nn2)cc1
InChIInChI=1S/C13H15N3O2/c1-17-8-9-18-11-4-2-10(3-5-11)12-6-7-13(14)16-15-12/h2-7H,8-9H2,1H3,(H2,14,16)
InChIKeyJBUFRRMYOQGRIM-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.75
Rot. Bonds5

About 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine

6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine (PubChem CID 96662586) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine
PubChem CID96662586
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine
SMILESCOCCOc1ccc(-c2ccc(N)nn2)cc1
InChIInChI=1S/C13H15N3O2/c1-17-8-9-18-11-4-2-10(3-5-11)12-6-7-13(14)16-15-12/h2-7H,8-9H2,1H3,(H2,14,16)
InChIKeyJBUFRRMYOQGRIM-UHFFFAOYSA-N
XLogP1.75
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-[4-(2-methoxyethoxy)phenyl]-N-methylpyridazin-3-amine
CID 98016971
4-[4-(2-methoxyethoxy)phenyl]-1,3-oxazol-2-amine
CID 95450329
5-[[4-(2-methoxyethoxy)phenyl]methyl]-1H-pyrazol-3-amine
CID 90156722
3,6-bis(4-decoxyphenyl)pyridazine
CID 101171713
6-(5-methoxy-2-pyridinyl)pyridazin-3-amine
CID 142791186
1-(2-methoxyethoxy)-4-phenylbenzene
CID 20582782
1-chloro-4-[4-[4-(2-methoxyethoxy)phenyl]phenyl]benzene
CID 71108634
1,2-bis[4-(2-methoxyethoxy)phenyl]ethane-1,2-diamine
CID 101255138
[4-[4-(2-methoxyethoxy)phenyl]-1,3-thiazol-2-yl]hydrazine
CID 95471163
(1R)-1-[6-[4-(2-methoxyethoxy)phenyl]-2-pyridinyl]ethanol
CID 126446543
[5-[4-(2-methoxyethoxy)phenyl]-1,3,4-thiadiazol-2-yl]methanamine
CID 98017803
6-(4-fluorophenyl)pyridazin-3-amine
CID 11030588

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine?
The IUPAC name of 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine (CID 96662586) is 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine.
What is the SMILES notation for 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine?
The canonical SMILES for 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine is COCCOc1ccc(-c2ccc(N)nn2)cc1.
What is the InChIKey of 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine?
The InChIKey is JBUFRRMYOQGRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-17-8-9-18-11-4-2-10(3-5-11)12-6-7-13(14)16-15-12/h2-7H,8-9H2,1H3,(H2,14,16).
What are the key properties of 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine?
6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine has a molecular weight of 245.28 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2-methoxyethoxy)phenyl]pyridazin-3-amine is sourced from PubChem (CID 96662586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).