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

C13H16N4 — CID 6410803

IUPACN'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
SMILESCc1cc(-c2ccccc2)nnc1NCCN
InChIInChI=1S/C13H16N4/c1-10-9-12(11-5-3-2-4-6-11)16-17-13(10)15-8-7-14/h2-6,9H,7-8,14H2,1H3,(H,15,17)
InChIKeyIAMNQWPFFLMKPU-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.82
Rot. Bonds4

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

N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine (PubChem CID 6410803) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
PubChem CID6410803
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC NameN'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine
SMILESCc1cc(-c2ccccc2)nnc1NCCN
InChIInChI=1S/C13H16N4/c1-10-9-12(11-5-3-2-4-6-11)16-17-13(10)15-8-7-14/h2-6,9H,7-8,14H2,1H3,(H,15,17)
InChIKeyIAMNQWPFFLMKPU-UHFFFAOYSA-N
XLogP1.82
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Minaprine
CID 4199
Minaprine Hydrochloride
CID 33254
Jnj-37822681
CID 16058752
SR 95191
CID 72119
N-benzyl-4-methylphthalazin-1-amine
CID 6401675
4-Morpholineethanamine, N-(4,6-diphenyl-3-pyridazinyl)-
CID 6410811
N-[2-(4-morpholinyl)ethyl]-6,7-dihydro-5H-benzo[2,3]cyclohepta[2,4-d]pyridazin-3-amine
CID 195165
CID 46891461
CID 46891461
4-Morpholineethanamine, N-(4-methyl-6-phenyl-3-pyridazinyl)-, monohydrochloride
CID 6410797
(3H)A-585539
CID 23643135
N,6-bis(4-fluorophenyl)pyridazin-3-amine
CID 6411189
N-(3-fluorophenyl)-6-(4-fluorophenyl)pyridazin-3-amine
CID 6411191

Frequently Asked Questions

What is the IUPAC name of N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The IUPAC name of N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine (CID 6410803) is N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine is Cc1cc(-c2ccccc2)nnc1NCCN.
What is the InChIKey of N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
The InChIKey is IAMNQWPFFLMKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-9-12(11-5-3-2-4-6-11)16-17-13(10)15-8-7-14/h2-6,9H,7-8,14H2,1H3,(H,15,17).
What are the key properties of N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine?
N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine has a molecular weight of 228.30 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methyl-6-phenylpyridazin-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 6410803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).