1-thiophen-2-ylpropan-2-amine

C7H11NS — CID 6484133

IUPAC1-thiophen-2-ylpropan-2-amine
SMILESCC(N)Cc1cccs1
InChIInChI=1S/C7H11NS/c1-6(8)5-7-3-2-4-9-7/h2-4,6H,5,8H2,1H3
InChIKeyNYVQQTOGYLBBDQ-UHFFFAOYSA-N
MW141.24 g/mol
LogP1.64
Rot. Bonds2

About 1-thiophen-2-ylpropan-2-amine

1-thiophen-2-ylpropan-2-amine (PubChem CID 6484133) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 1-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-thiophen-2-ylpropan-2-amine
PubChem CID6484133
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name1-thiophen-2-ylpropan-2-amine
SMILESCC(N)Cc1cccs1
InChIInChI=1S/C7H11NS/c1-6(8)5-7-3-2-4-9-7/h2-4,6H,5,8H2,1H3
InChIKeyNYVQQTOGYLBBDQ-UHFFFAOYSA-N
XLogP1.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-thiophen-2-ylpropan-2-amine?
The IUPAC name of 1-thiophen-2-ylpropan-2-amine (CID 6484133) is 1-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for 1-thiophen-2-ylpropan-2-amine?
The canonical SMILES for 1-thiophen-2-ylpropan-2-amine is CC(N)Cc1cccs1.
What is the InChIKey of 1-thiophen-2-ylpropan-2-amine?
The InChIKey is NYVQQTOGYLBBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-6(8)5-7-3-2-4-9-7/h2-4,6H,5,8H2,1H3.
What are the key properties of 1-thiophen-2-ylpropan-2-amine?
1-thiophen-2-ylpropan-2-amine has a molecular weight of 141.24 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 6484133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).