N-propyl-1-thiophen-2-ylpropan-2-amine

C10H17NS — CID 43692824

IUPACN-propyl-1-thiophen-2-ylpropan-2-amine
SMILESCCCNC(C)Cc1cccs1
InChIInChI=1S/C10H17NS/c1-3-6-11-9(2)8-10-5-4-7-12-10/h4-5,7,9,11H,3,6,8H2,1-2H3
InChIKeyOEMGSTNHBGXOJT-UHFFFAOYSA-N
MW183.32 g/mol
LogP2.68
Rot. Bonds5

About N-propyl-1-thiophen-2-ylpropan-2-amine

N-propyl-1-thiophen-2-ylpropan-2-amine (PubChem CID 43692824) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is N-propyl-1-thiophen-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-propyl-1-thiophen-2-ylpropan-2-amine
PubChem CID43692824
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC NameN-propyl-1-thiophen-2-ylpropan-2-amine
SMILESCCCNC(C)Cc1cccs1
InChIInChI=1S/C10H17NS/c1-3-6-11-9(2)8-10-5-4-7-12-10/h4-5,7,9,11H,3,6,8H2,1-2H3
InChIKeyOEMGSTNHBGXOJT-UHFFFAOYSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propyl-1-thiophen-2-ylpropan-2-amine?
The IUPAC name of N-propyl-1-thiophen-2-ylpropan-2-amine (CID 43692824) is N-propyl-1-thiophen-2-ylpropan-2-amine.
What is the SMILES notation for N-propyl-1-thiophen-2-ylpropan-2-amine?
The canonical SMILES for N-propyl-1-thiophen-2-ylpropan-2-amine is CCCNC(C)Cc1cccs1.
What is the InChIKey of N-propyl-1-thiophen-2-ylpropan-2-amine?
The InChIKey is OEMGSTNHBGXOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-3-6-11-9(2)8-10-5-4-7-12-10/h4-5,7,9,11H,3,6,8H2,1-2H3.
What are the key properties of N-propyl-1-thiophen-2-ylpropan-2-amine?
N-propyl-1-thiophen-2-ylpropan-2-amine has a molecular weight of 183.32 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-thiophen-2-ylpropan-2-amine is sourced from PubChem (CID 43692824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).