5-propyl-3-pyridin-2-ylthiophen-2-amine

C12H14N2S — CID 60988143

IUPAC5-propyl-3-pyridin-2-ylthiophen-2-amine
SMILESCCCc1cc(-c2ccccn2)c(N)s1
InChIInChI=1S/C12H14N2S/c1-2-5-9-8-10(12(13)15-9)11-6-3-4-7-14-11/h3-4,6-8H,2,5,13H2,1H3
InChIKeyZHHYDPISPFTALR-UHFFFAOYSA-N
MW218.32 g/mol
LogP3.34
Rot. Bonds3

About 5-propyl-3-pyridin-2-ylthiophen-2-amine

5-propyl-3-pyridin-2-ylthiophen-2-amine (PubChem CID 60988143) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 5-propyl-3-pyridin-2-ylthiophen-2-amine.

Molecular Properties

Compound Name5-propyl-3-pyridin-2-ylthiophen-2-amine
PubChem CID60988143
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC Name5-propyl-3-pyridin-2-ylthiophen-2-amine
SMILESCCCc1cc(-c2ccccn2)c(N)s1
InChIInChI=1S/C12H14N2S/c1-2-5-9-8-10(12(13)15-9)11-6-3-4-7-14-11/h3-4,6-8H,2,5,13H2,1H3
InChIKeyZHHYDPISPFTALR-UHFFFAOYSA-N
XLogP3.34
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-3-pyridin-2-ylthiophen-2-amine?
The IUPAC name of 5-propyl-3-pyridin-2-ylthiophen-2-amine (CID 60988143) is 5-propyl-3-pyridin-2-ylthiophen-2-amine.
What is the SMILES notation for 5-propyl-3-pyridin-2-ylthiophen-2-amine?
The canonical SMILES for 5-propyl-3-pyridin-2-ylthiophen-2-amine is CCCc1cc(-c2ccccn2)c(N)s1.
What is the InChIKey of 5-propyl-3-pyridin-2-ylthiophen-2-amine?
The InChIKey is ZHHYDPISPFTALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-2-5-9-8-10(12(13)15-9)11-6-3-4-7-14-11/h3-4,6-8H,2,5,13H2,1H3.
What are the key properties of 5-propyl-3-pyridin-2-ylthiophen-2-amine?
5-propyl-3-pyridin-2-ylthiophen-2-amine has a molecular weight of 218.32 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-3-pyridin-2-ylthiophen-2-amine is sourced from PubChem (CID 60988143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).