N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine

C11H20N4 — CID 61313304

IUPACN',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1ccc(C)nn1
InChIInChI=1S/C11H20N4/c1-4-15(5-2)9-8-12-11-7-6-10(3)13-14-11/h6-7H,4-5,8-9H2,1-3H3,(H,12,14)
InChIKeyNTRZJLAXHRMOIZ-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.54
Rot. Bonds6

About N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine

N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine (PubChem CID 61313304) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine
PubChem CID61313304
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1ccc(C)nn1
InChIInChI=1S/C11H20N4/c1-4-15(5-2)9-8-12-11-7-6-10(3)13-14-11/h6-7H,4-5,8-9H2,1-3H3,(H,12,14)
InChIKeyNTRZJLAXHRMOIZ-UHFFFAOYSA-N
XLogP1.54
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.54
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-(6-methylpyridazin-3-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine (CID 61313304) is N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine is CCN(CC)CCNc1ccc(C)nn1.
What is the InChIKey of N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine?
The InChIKey is NTRZJLAXHRMOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-4-15(5-2)9-8-12-11-7-6-10(3)13-14-11/h6-7H,4-5,8-9H2,1-3H3,(H,12,14).
What are the key properties of N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine has a molecular weight of 208.31 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(6-methylpyridazin-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 61313304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).