N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine

C17H24N4 — CID 6410807

IUPACN',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1nnc(-c2ccccc2)cc1C
InChIInChI=1S/C17H24N4/c1-4-21(5-2)12-11-18-17-14(3)13-16(19-20-17)15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3,(H,18,20)
InChIKeyAGADJCRPQYMCDF-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.21
Rot. Bonds7

About N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine

N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine (PubChem CID 6410807) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
PubChem CID6410807
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1nnc(-c2ccccc2)cc1C
InChIInChI=1S/C17H24N4/c1-4-21(5-2)12-11-18-17-14(3)13-16(19-20-17)15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3,(H,18,20)
InChIKeyAGADJCRPQYMCDF-UHFFFAOYSA-N
XLogP3.21
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine (CID 6410807) is N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine is CCN(CC)CCNc1nnc(-c2ccccc2)cc1C.
What is the InChIKey of N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The InChIKey is AGADJCRPQYMCDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-4-21(5-2)12-11-18-17-14(3)13-16(19-20-17)15-9-7-6-8-10-15/h6-10,13H,4-5,11-12H2,1-3H3,(H,18,20).
What are the key properties of N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine has a molecular weight of 284.41 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 6410807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).