4-(aminomethyl)thiophen-2-amine;hydrochloride

C5H9ClN2S — CID 141029895

IUPAC4-(aminomethyl)thiophen-2-amine;hydrochloride
SMILESCl.NCc1csc(N)c1
InChIInChI=1S/C5H8N2S.ClH/c6-2-4-1-5(7)8-3-4;/h1,3H,2,6-7H2;1H
InChIKeySYWQVGMYJANBEJ-UHFFFAOYSA-N
MW164.66 g/mol
LogP1.21
Rot. Bonds1

About 4-(aminomethyl)thiophen-2-amine;hydrochloride

4-(aminomethyl)thiophen-2-amine;hydrochloride (PubChem CID 141029895) has the molecular formula C5H9ClN2S and a molecular weight of 164.66 g/mol. Its IUPAC name is 4-(aminomethyl)thiophen-2-amine;hydrochloride.

Molecular Properties

Compound Name4-(aminomethyl)thiophen-2-amine;hydrochloride
PubChem CID141029895
Molecular FormulaC5H9ClN2S
Molecular Weight164.66 g/mol
Exact Mass164.02
IUPAC Name4-(aminomethyl)thiophen-2-amine;hydrochloride
SMILESCl.NCc1csc(N)c1
InChIInChI=1S/C5H8N2S.ClH/c6-2-4-1-5(7)8-3-4;/h1,3H,2,6-7H2;1H
InChIKeySYWQVGMYJANBEJ-UHFFFAOYSA-N
XLogP1.21
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.66
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)thiophen-2-amine;hydrochloride?
The IUPAC name of 4-(aminomethyl)thiophen-2-amine;hydrochloride (CID 141029895) is 4-(aminomethyl)thiophen-2-amine;hydrochloride.
What is the SMILES notation for 4-(aminomethyl)thiophen-2-amine;hydrochloride?
The canonical SMILES for 4-(aminomethyl)thiophen-2-amine;hydrochloride is Cl.NCc1csc(N)c1.
What is the InChIKey of 4-(aminomethyl)thiophen-2-amine;hydrochloride?
The InChIKey is SYWQVGMYJANBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S.ClH/c6-2-4-1-5(7)8-3-4;/h1,3H,2,6-7H2;1H.
What are the key properties of 4-(aminomethyl)thiophen-2-amine;hydrochloride?
4-(aminomethyl)thiophen-2-amine;hydrochloride has a molecular weight of 164.66 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)thiophen-2-amine;hydrochloride is sourced from PubChem (CID 141029895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).