N-(2-pyridin-4-ylethyl)thiophen-3-amine

C11H12N2S — CID 66351702

IUPACN-(2-pyridin-4-ylethyl)thiophen-3-amine
SMILESc1cc(CCNc2ccsc2)ccn1
InChIInChI=1S/C11H12N2S/c1-5-12-6-2-10(1)3-7-13-11-4-8-14-9-11/h1-2,4-6,8-9,13H,3,7H2
InChIKeyDLXKECBWXLHQLI-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.80
Rot. Bonds4

About N-(2-pyridin-4-ylethyl)thiophen-3-amine

N-(2-pyridin-4-ylethyl)thiophen-3-amine (PubChem CID 66351702) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is N-(2-pyridin-4-ylethyl)thiophen-3-amine.

Molecular Properties

Compound NameN-(2-pyridin-4-ylethyl)thiophen-3-amine
PubChem CID66351702
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC NameN-(2-pyridin-4-ylethyl)thiophen-3-amine
SMILESc1cc(CCNc2ccsc2)ccn1
InChIInChI=1S/C11H12N2S/c1-5-12-6-2-10(1)3-7-13-11-4-8-14-9-11/h1-2,4-6,8-9,13H,3,7H2
InChIKeyDLXKECBWXLHQLI-UHFFFAOYSA-N
XLogP2.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-4-ylethyl)thiophen-3-amine?
The IUPAC name of N-(2-pyridin-4-ylethyl)thiophen-3-amine (CID 66351702) is N-(2-pyridin-4-ylethyl)thiophen-3-amine.
What is the SMILES notation for N-(2-pyridin-4-ylethyl)thiophen-3-amine?
The canonical SMILES for N-(2-pyridin-4-ylethyl)thiophen-3-amine is c1cc(CCNc2ccsc2)ccn1.
What is the InChIKey of N-(2-pyridin-4-ylethyl)thiophen-3-amine?
The InChIKey is DLXKECBWXLHQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-5-12-6-2-10(1)3-7-13-11-4-8-14-9-11/h1-2,4-6,8-9,13H,3,7H2.
What are the key properties of N-(2-pyridin-4-ylethyl)thiophen-3-amine?
N-(2-pyridin-4-ylethyl)thiophen-3-amine has a molecular weight of 204.30 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-4-ylethyl)thiophen-3-amine is sourced from PubChem (CID 66351702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).