N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine

C10H18N4S — CID 133356168

IUPACN,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine
SMILESCSc1ccc(N(C)CCN(C)C)nn1
InChIInChI=1S/C10H18N4S/c1-13(2)7-8-14(3)9-5-6-10(15-4)12-11-9/h5-6H,7-8H2,1-4H3
InChIKeyUYAZDYFVQIFAJP-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.20
Rot. Bonds5

About N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine

N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine (PubChem CID 133356168) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine
PubChem CID133356168
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine
SMILESCSc1ccc(N(C)CCN(C)C)nn1
InChIInChI=1S/C10H18N4S/c1-13(2)7-8-14(3)9-5-6-10(15-4)12-11-9/h5-6H,7-8H2,1-4H3
InChIKeyUYAZDYFVQIFAJP-UHFFFAOYSA-N
XLogP1.20
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[methyl-(6-methylsulfanylpyridazin-3-yl)amino]propanenitrile
CID 133381576
N'-(6-chloropyridazin-3-yl)-N,N,N'-trimethylethane-1,2-diamine
CID 63701006
N-[3-[methyl-(6-methylsulfanylpyridazin-3-yl)amino]propyl]acetamide
CID 133303912
N-methyl-6-methylsulfanyl-N-[(2R)-2-phenylpropyl]pyridazin-3-amine
CID 99807689
N,N,N'-trimethyl-N'-[6-[(propan-2-ylamino)methyl]pyridazin-3-yl]ethane-1,2-diamine
CID 55226791
N'-(6-chloropyridazin-3-yl)-N,N,N'-trimethylpropane-1,3-diamine
CID 63698928
N,N,N'-trimethyl-N'-(6-propan-2-ylpyridazin-3-yl)propane-1,3-diamine
CID 70912583
N-methyl-6-methylsulfanyl-N-(1-propan-2-ylpiperidin-4-yl)pyridazin-3-amine
CID 133334272
2-N-[2-(dimethylamino)ethyl]-2-N,5-N-dimethylpyridine-2,5-diamine
CID 143709884
N,N,N'-trimethyl-N'-(2-methylsulfanylphenyl)ethane-1,2-diamine
CID 142074179
2-[2-(dimethylamino)ethyl-methylamino]pyridine-4-carbothioamide
CID 63695419
3-hydroperoxy-6-methylsulfanylpyridazine
CID 88641008

Frequently Asked Questions

What is the IUPAC name of N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine?
The IUPAC name of N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine (CID 133356168) is N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine?
The canonical SMILES for N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine is CSc1ccc(N(C)CCN(C)C)nn1.
What is the InChIKey of N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine?
The InChIKey is UYAZDYFVQIFAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-13(2)7-8-14(3)9-5-6-10(15-4)12-11-9/h5-6H,7-8H2,1-4H3.
What are the key properties of N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine?
N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine has a molecular weight of 226.35 g/mol, XLogP of 1.20, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N'-trimethyl-N'-(6-methylsulfanylpyridazin-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 133356168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).