2,5-dimethylthiophene-3,4-diamine

C6H10N2S — CID 15133594

IUPAC2,5-dimethylthiophene-3,4-diamine
SMILESCc1sc(C)c(N)c1N
InChIInChI=1S/C6H10N2S/c1-3-5(7)6(8)4(2)9-3/h7-8H2,1-2H3
InChIKeyNJPZKGHIAIJHRL-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.53
Rot. Bonds

About 2,5-dimethylthiophene-3,4-diamine

2,5-dimethylthiophene-3,4-diamine (PubChem CID 15133594) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is 2,5-dimethylthiophene-3,4-diamine.

Molecular Properties

Compound Name2,5-dimethylthiophene-3,4-diamine
PubChem CID15133594
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name2,5-dimethylthiophene-3,4-diamine
SMILESCc1sc(C)c(N)c1N
InChIInChI=1S/C6H10N2S/c1-3-5(7)6(8)4(2)9-3/h7-8H2,1-2H3
InChIKeyNJPZKGHIAIJHRL-UHFFFAOYSA-N
XLogP1.53
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylthiophene-3,4-diamine?
The IUPAC name of 2,5-dimethylthiophene-3,4-diamine (CID 15133594) is 2,5-dimethylthiophene-3,4-diamine.
What is the SMILES notation for 2,5-dimethylthiophene-3,4-diamine?
The canonical SMILES for 2,5-dimethylthiophene-3,4-diamine is Cc1sc(C)c(N)c1N.
What is the InChIKey of 2,5-dimethylthiophene-3,4-diamine?
The InChIKey is NJPZKGHIAIJHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-3-5(7)6(8)4(2)9-3/h7-8H2,1-2H3.
What are the key properties of 2,5-dimethylthiophene-3,4-diamine?
2,5-dimethylthiophene-3,4-diamine has a molecular weight of 142.23 g/mol, XLogP of 1.53, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylthiophene-3,4-diamine is sourced from PubChem (CID 15133594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).