2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine

C10H9ClN2S — CID 130653950

IUPAC2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine
SMILESClc1sccc1NCc1cccnc1
InChIInChI=1S/C10H9ClN2S/c11-10-9(3-5-14-10)13-7-8-2-1-4-12-6-8/h1-6,13H,7H2
InChIKeyWKQTYYPYASXBCV-UHFFFAOYSA-N
MW224.72 g/mol
LogP3.41
Rot. Bonds3

About 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine

2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine (PubChem CID 130653950) has the molecular formula C10H9ClN2S and a molecular weight of 224.72 g/mol. Its IUPAC name is 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine.

Molecular Properties

Compound Name2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine
PubChem CID130653950
Molecular FormulaC10H9ClN2S
Molecular Weight224.72 g/mol
Exact Mass224.02
IUPAC Name2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine
SMILESClc1sccc1NCc1cccnc1
InChIInChI=1S/C10H9ClN2S/c11-10-9(3-5-14-10)13-7-8-2-1-4-12-6-8/h1-6,13H,7H2
InChIKeyWKQTYYPYASXBCV-UHFFFAOYSA-N
XLogP3.41
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.72
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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2-N-(pyridin-3-ylmethyl)benzene-1,2-diamine
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[2-(pyridin-3-ylmethylamino)phenyl]methanol
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N-(pyridin-3-ylmethyl)isoquinolin-5-amine
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2,6-dichloro-4-(pyridin-3-ylmethylamino)phenol
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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine?
The IUPAC name of 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine (CID 130653950) is 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine.
What is the SMILES notation for 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine?
The canonical SMILES for 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine is Clc1sccc1NCc1cccnc1.
What is the InChIKey of 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine?
The InChIKey is WKQTYYPYASXBCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2S/c11-10-9(3-5-14-10)13-7-8-2-1-4-12-6-8/h1-6,13H,7H2.
What are the key properties of 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine?
2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine has a molecular weight of 224.72 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(pyridin-3-ylmethyl)thiophen-3-amine is sourced from PubChem (CID 130653950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).