N-propan-2-yl-1-thiophen-3-ylpropan-2-amine

C10H17NS — CID 61473291

IUPACN-propan-2-yl-1-thiophen-3-ylpropan-2-amine
SMILESCC(C)NC(C)Cc1ccsc1
InChIInChI=1S/C10H17NS/c1-8(2)11-9(3)6-10-4-5-12-7-10/h4-5,7-9,11H,6H2,1-3H3
InChIKeyWZJCWFLCXSSMFX-UHFFFAOYSA-N
MW183.32 g/mol
LogP2.68
Rot. Bonds4

About N-propan-2-yl-1-thiophen-3-ylpropan-2-amine

N-propan-2-yl-1-thiophen-3-ylpropan-2-amine (PubChem CID 61473291) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is N-propan-2-yl-1-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-propan-2-yl-1-thiophen-3-ylpropan-2-amine
PubChem CID61473291
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC NameN-propan-2-yl-1-thiophen-3-ylpropan-2-amine
SMILESCC(C)NC(C)Cc1ccsc1
InChIInChI=1S/C10H17NS/c1-8(2)11-9(3)6-10-4-5-12-7-10/h4-5,7-9,11H,6H2,1-3H3
InChIKeyWZJCWFLCXSSMFX-UHFFFAOYSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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-propan-2-yl-1-thiophen-3-ylpropan-2-amine?
The IUPAC name of N-propan-2-yl-1-thiophen-3-ylpropan-2-amine (CID 61473291) is N-propan-2-yl-1-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for N-propan-2-yl-1-thiophen-3-ylpropan-2-amine?
The canonical SMILES for N-propan-2-yl-1-thiophen-3-ylpropan-2-amine is CC(C)NC(C)Cc1ccsc1.
What is the InChIKey of N-propan-2-yl-1-thiophen-3-ylpropan-2-amine?
The InChIKey is WZJCWFLCXSSMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-8(2)11-9(3)6-10-4-5-12-7-10/h4-5,7-9,11H,6H2,1-3H3.
What are the key properties of N-propan-2-yl-1-thiophen-3-ylpropan-2-amine?
N-propan-2-yl-1-thiophen-3-ylpropan-2-amine has a molecular weight of 183.32 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 61473291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).