(2-thiophen-2-ylthiophen-3-yl)methanamine

C9H9NS2 — CID 53446913

IUPAC(2-thiophen-2-ylthiophen-3-yl)methanamine
SMILESNCc1ccsc1-c1cccs1
InChIInChI=1S/C9H9NS2/c10-6-7-3-5-12-9(7)8-2-1-4-11-8/h1-5H,6,10H2
InChIKeyLIORGGAWGJPFDE-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.94
Rot. Bonds2

About (2-thiophen-2-ylthiophen-3-yl)methanamine

(2-thiophen-2-ylthiophen-3-yl)methanamine (PubChem CID 53446913) has the molecular formula C9H9NS2 and a molecular weight of 195.31 g/mol. Its IUPAC name is (2-thiophen-2-ylthiophen-3-yl)methanamine.

Molecular Properties

Compound Name(2-thiophen-2-ylthiophen-3-yl)methanamine
PubChem CID53446913
Molecular FormulaC9H9NS2
Molecular Weight195.31 g/mol
Exact Mass195.02
IUPAC Name(2-thiophen-2-ylthiophen-3-yl)methanamine
SMILESNCc1ccsc1-c1cccs1
InChIInChI=1S/C9H9NS2/c10-6-7-3-5-12-9(7)8-2-1-4-11-8/h1-5H,6,10H2
InChIKeyLIORGGAWGJPFDE-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-thiophen-2-ylthiophen-3-yl)methanamine?
The IUPAC name of (2-thiophen-2-ylthiophen-3-yl)methanamine (CID 53446913) is (2-thiophen-2-ylthiophen-3-yl)methanamine.
What is the SMILES notation for (2-thiophen-2-ylthiophen-3-yl)methanamine?
The canonical SMILES for (2-thiophen-2-ylthiophen-3-yl)methanamine is NCc1ccsc1-c1cccs1.
What is the InChIKey of (2-thiophen-2-ylthiophen-3-yl)methanamine?
The InChIKey is LIORGGAWGJPFDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NS2/c10-6-7-3-5-12-9(7)8-2-1-4-11-8/h1-5H,6,10H2.
What are the key properties of (2-thiophen-2-ylthiophen-3-yl)methanamine?
(2-thiophen-2-ylthiophen-3-yl)methanamine has a molecular weight of 195.31 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-thiophen-2-ylthiophen-3-yl)methanamine is sourced from PubChem (CID 53446913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).