2-methyl-1-thiophen-2-ylpropan-1-amine

C8H13NS — CID 3159240

IUPAC2-methyl-1-thiophen-2-ylpropan-1-amine
SMILESCC(C)C(N)c1cccs1
InChIInChI=1S/C8H13NS/c1-6(2)8(9)7-4-3-5-10-7/h3-6,8H,9H2,1-2H3
InChIKeyVJVICAYVXMSTAM-UHFFFAOYSA-N
MW155.27 g/mol
LogP2.40
Rot. Bonds2

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

2-methyl-1-thiophen-2-ylpropan-1-amine (PubChem CID 3159240) has the molecular formula C8H13NS and a molecular weight of 155.27 g/mol. Its IUPAC name is 2-methyl-1-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-1-thiophen-2-ylpropan-1-amine
PubChem CID3159240
Molecular FormulaC8H13NS
Molecular Weight155.27 g/mol
Exact Mass155.08
IUPAC Name2-methyl-1-thiophen-2-ylpropan-1-amine
SMILESCC(C)C(N)c1cccs1
InChIInChI=1S/C8H13NS/c1-6(2)8(9)7-4-3-5-10-7/h3-6,8H,9H2,1-2H3
InChIKeyVJVICAYVXMSTAM-UHFFFAOYSA-N
XLogP2.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.27
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-thiophen-2-ylpropan-1-amine?
The IUPAC name of 2-methyl-1-thiophen-2-ylpropan-1-amine (CID 3159240) is 2-methyl-1-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-1-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 2-methyl-1-thiophen-2-ylpropan-1-amine is CC(C)C(N)c1cccs1.
What is the InChIKey of 2-methyl-1-thiophen-2-ylpropan-1-amine?
The InChIKey is VJVICAYVXMSTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NS/c1-6(2)8(9)7-4-3-5-10-7/h3-6,8H,9H2,1-2H3.
What are the key properties of 2-methyl-1-thiophen-2-ylpropan-1-amine?
2-methyl-1-thiophen-2-ylpropan-1-amine has a molecular weight of 155.27 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 3159240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).