N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine

C15H28N4O2 — CID 62287618

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine
SMILESCCCNCc1ccc(N(CCOC)C(C)COC)nn1
InChIInChI=1S/C15H28N4O2/c1-5-8-16-11-14-6-7-15(18-17-14)19(9-10-20-3)13(2)12-21-4/h6-7,13,16H,5,8-12H2,1-4H3
InChIKeyLUJNTZXTLQHNDV-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.46
Rot. Bonds11

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine (PubChem CID 62287618) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine
PubChem CID62287618
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine
SMILESCCCNCc1ccc(N(CCOC)C(C)COC)nn1
InChIInChI=1S/C15H28N4O2/c1-5-8-16-11-14-6-7-15(18-17-14)19(9-10-20-3)13(2)12-21-4/h6-7,13,16H,5,8-12H2,1-4H3
InChIKeyLUJNTZXTLQHNDV-UHFFFAOYSA-N
XLogP1.46
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine (CID 62287618) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine is CCCNCc1ccc(N(CCOC)C(C)COC)nn1.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine?
The InChIKey is LUJNTZXTLQHNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-5-8-16-11-14-6-7-15(18-17-14)19(9-10-20-3)13(2)12-21-4/h6-7,13,16H,5,8-12H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine has a molecular weight of 296.42 g/mol, XLogP of 1.46, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-6-(propylaminomethyl)pyridazin-3-amine is sourced from PubChem (CID 62287618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).