2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine

C12H14N2OS — CID 43721891

IUPAC2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine
SMILESCOc1ncccc1NC(C)c1cccs1
InChIInChI=1S/C12H14N2OS/c1-9(11-6-4-8-16-11)14-10-5-3-7-13-12(10)15-2/h3-9,14H,1-2H3
InChIKeyGZTOXCNDQWHYLW-UHFFFAOYSA-N
MW234.32 g/mol
LogP3.32
Rot. Bonds4

About 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine

2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine (PubChem CID 43721891) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine
PubChem CID43721891
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine
SMILESCOc1ncccc1NC(C)c1cccs1
InChIInChI=1S/C12H14N2OS/c1-9(11-6-4-8-16-11)14-10-5-3-7-13-12(10)15-2/h3-9,14H,1-2H3
InChIKeyGZTOXCNDQWHYLW-UHFFFAOYSA-N
XLogP3.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The IUPAC name of 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine (CID 43721891) is 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine is COc1ncccc1NC(C)c1cccs1.
What is the InChIKey of 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The InChIKey is GZTOXCNDQWHYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c1-9(11-6-4-8-16-11)14-10-5-3-7-13-12(10)15-2/h3-9,14H,1-2H3.
What are the key properties of 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine has a molecular weight of 234.32 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine is sourced from PubChem (CID 43721891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).