N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine

C12H14N2S — CID 63292001

IUPACN-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine
SMILESCC(Cc1cccs1)Nc1ccncc1
InChIInChI=1S/C12H14N2S/c1-10(9-12-3-2-8-15-12)14-11-4-6-13-7-5-11/h2-8,10H,9H2,1H3,(H,13,14)
InChIKeyJCIOYBGOPXKGJL-UHFFFAOYSA-N
MW218.33 g/mol
LogP3.19
Rot. Bonds4

About N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine

N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine (PubChem CID 63292001) has the molecular formula C12H14N2S and a molecular weight of 218.33 g/mol. Its IUPAC name is N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine.

Molecular Properties

Compound NameN-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine
PubChem CID63292001
Molecular FormulaC12H14N2S
Molecular Weight218.33 g/mol
Exact Mass218.09
IUPAC NameN-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine
SMILESCC(Cc1cccs1)Nc1ccncc1
InChIInChI=1S/C12H14N2S/c1-10(9-12-3-2-8-15-12)14-11-4-6-13-7-5-11/h2-8,10H,9H2,1H3,(H,13,14)
InChIKeyJCIOYBGOPXKGJL-UHFFFAOYSA-N
XLogP3.19
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine?
The IUPAC name of N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine (CID 63292001) is N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine.
What is the SMILES notation for N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine?
The canonical SMILES for N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine is CC(Cc1cccs1)Nc1ccncc1.
What is the InChIKey of N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine?
The InChIKey is JCIOYBGOPXKGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-10(9-12-3-2-8-15-12)14-11-4-6-13-7-5-11/h2-8,10H,9H2,1H3,(H,13,14).
What are the key properties of N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine?
N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine has a molecular weight of 218.33 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylpropan-2-yl)pyridin-4-amine is sourced from PubChem (CID 63292001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).