3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine

C10H20N4S — CID 12683489

IUPAC3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine
SMILESCCN(CC)c1nsc(N(CC)CC)n1
InChIInChI=1S/C10H20N4S/c1-5-13(6-2)9-11-10(15-12-9)14(7-3)8-4/h5-8H2,1-4H3
InChIKeyMQLJCSMKRBIHOG-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.23
Rot. Bonds6

About 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine

3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine (PubChem CID 12683489) has the molecular formula C10H20N4S and a molecular weight of 228.36 g/mol. Its IUPAC name is 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine
PubChem CID12683489
Molecular FormulaC10H20N4S
Molecular Weight228.36 g/mol
Exact Mass228.14
IUPAC Name3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine
SMILESCCN(CC)c1nsc(N(CC)CC)n1
InChIInChI=1S/C10H20N4S/c1-5-13(6-2)9-11-10(15-12-9)14(7-3)8-4/h5-8H2,1-4H3
InChIKeyMQLJCSMKRBIHOG-UHFFFAOYSA-N
XLogP2.23
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine?
The IUPAC name of 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine (CID 12683489) is 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine?
The canonical SMILES for 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine is CCN(CC)c1nsc(N(CC)CC)n1.
What is the InChIKey of 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine?
The InChIKey is MQLJCSMKRBIHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4S/c1-5-13(6-2)9-11-10(15-12-9)14(7-3)8-4/h5-8H2,1-4H3.
What are the key properties of 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine?
3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine has a molecular weight of 228.36 g/mol, XLogP of 2.23, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,5-N,5-N-tetraethyl-1,2,4-thiadiazole-3,5-diamine is sourced from PubChem (CID 12683489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).