2-thiophen-3-yl-1,3-dihydroinden-2-amine

C13H13NS — CID 65099342

IUPAC2-thiophen-3-yl-1,3-dihydroinden-2-amine
SMILESNC1(c2ccsc2)Cc2ccccc2C1
InChIInChI=1S/C13H13NS/c14-13(12-5-6-15-9-12)7-10-3-1-2-4-11(10)8-13/h1-6,9H,7-8,14H2
InChIKeyHPGOIRBHKZDVFE-UHFFFAOYSA-N
MW215.32 g/mol
LogP2.70
Rot. Bonds1

About 2-thiophen-3-yl-1,3-dihydroinden-2-amine

2-thiophen-3-yl-1,3-dihydroinden-2-amine (PubChem CID 65099342) has the molecular formula C13H13NS and a molecular weight of 215.32 g/mol. Its IUPAC name is 2-thiophen-3-yl-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-thiophen-3-yl-1,3-dihydroinden-2-amine
PubChem CID65099342
Molecular FormulaC13H13NS
Molecular Weight215.32 g/mol
Exact Mass215.08
IUPAC Name2-thiophen-3-yl-1,3-dihydroinden-2-amine
SMILESNC1(c2ccsc2)Cc2ccccc2C1
InChIInChI=1S/C13H13NS/c14-13(12-5-6-15-9-12)7-10-3-1-2-4-11(10)8-13/h1-6,9H,7-8,14H2
InChIKeyHPGOIRBHKZDVFE-UHFFFAOYSA-N
XLogP2.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-3-yl-1,3-dihydroinden-2-amine?
The IUPAC name of 2-thiophen-3-yl-1,3-dihydroinden-2-amine (CID 65099342) is 2-thiophen-3-yl-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-thiophen-3-yl-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-thiophen-3-yl-1,3-dihydroinden-2-amine is NC1(c2ccsc2)Cc2ccccc2C1.
What is the InChIKey of 2-thiophen-3-yl-1,3-dihydroinden-2-amine?
The InChIKey is HPGOIRBHKZDVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NS/c14-13(12-5-6-15-9-12)7-10-3-1-2-4-11(10)8-13/h1-6,9H,7-8,14H2.
What are the key properties of 2-thiophen-3-yl-1,3-dihydroinden-2-amine?
2-thiophen-3-yl-1,3-dihydroinden-2-amine has a molecular weight of 215.32 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-3-yl-1,3-dihydroinden-2-amine is sourced from PubChem (CID 65099342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).