2-N-methylthiophene-2,5-diamine

C5H8N2S — CID 23287034

IUPAC2-N-methylthiophene-2,5-diamine
SMILESCNc1ccc(N)s1
InChIInChI=1S/C5H8N2S/c1-7-5-3-2-4(6)8-5/h2-3,7H,6H2,1H3
InChIKeyKSLIPASKKBUREZ-UHFFFAOYSA-N
MW128.20 g/mol
LogP1.37
Rot. Bonds1

About 2-N-methylthiophene-2,5-diamine

2-N-methylthiophene-2,5-diamine (PubChem CID 23287034) has the molecular formula C5H8N2S and a molecular weight of 128.20 g/mol. Its IUPAC name is 2-N-methylthiophene-2,5-diamine.

Molecular Properties

Compound Name2-N-methylthiophene-2,5-diamine
PubChem CID23287034
Molecular FormulaC5H8N2S
Molecular Weight128.20 g/mol
Exact Mass128.04
IUPAC Name2-N-methylthiophene-2,5-diamine
SMILESCNc1ccc(N)s1
InChIInChI=1S/C5H8N2S/c1-7-5-3-2-4(6)8-5/h2-3,7H,6H2,1H3
InChIKeyKSLIPASKKBUREZ-UHFFFAOYSA-N
XLogP1.37
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.20
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-methylthiophene-2,5-diamine?
The IUPAC name of 2-N-methylthiophene-2,5-diamine (CID 23287034) is 2-N-methylthiophene-2,5-diamine.
What is the SMILES notation for 2-N-methylthiophene-2,5-diamine?
The canonical SMILES for 2-N-methylthiophene-2,5-diamine is CNc1ccc(N)s1.
What is the InChIKey of 2-N-methylthiophene-2,5-diamine?
The InChIKey is KSLIPASKKBUREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S/c1-7-5-3-2-4(6)8-5/h2-3,7H,6H2,1H3.
What are the key properties of 2-N-methylthiophene-2,5-diamine?
2-N-methylthiophene-2,5-diamine has a molecular weight of 128.20 g/mol, XLogP of 1.37, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methylthiophene-2,5-diamine is sourced from PubChem (CID 23287034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).