2-(4-chlorophenyl)thiophen-3-amine;hydrochloride

C10H9Cl2NS — CID 56601035

IUPAC2-(4-chlorophenyl)thiophen-3-amine;hydrochloride
SMILESCl.Nc1ccsc1-c1ccc(Cl)cc1
InChIInChI=1S/C10H8ClNS.ClH/c11-8-3-1-7(2-4-8)10-9(12)5-6-13-10;/h1-6H,12H2;1H
InChIKeyKWRXCICADFRBBE-UHFFFAOYSA-N
MW246.16 g/mol
LogP4.07
Rot. Bonds1

About 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride

2-(4-chlorophenyl)thiophen-3-amine;hydrochloride (PubChem CID 56601035) has the molecular formula C10H9Cl2NS and a molecular weight of 246.16 g/mol. Its IUPAC name is 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride.

Molecular Properties

Compound Name2-(4-chlorophenyl)thiophen-3-amine;hydrochloride
PubChem CID56601035
Molecular FormulaC10H9Cl2NS
Molecular Weight246.16 g/mol
Exact Mass244.98
IUPAC Name2-(4-chlorophenyl)thiophen-3-amine;hydrochloride
SMILESCl.Nc1ccsc1-c1ccc(Cl)cc1
InChIInChI=1S/C10H8ClNS.ClH/c11-8-3-1-7(2-4-8)10-9(12)5-6-13-10;/h1-6H,12H2;1H
InChIKeyKWRXCICADFRBBE-UHFFFAOYSA-N
XLogP4.07
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.16
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(4-Chlorophenyl)(thiophen-2-yl)methanamine hydrochloride
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2-(4-Chlorophenyl)thiophen-3-amine
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4-Phenylthiophen-3-amine hydrochloride
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2-Phenylthiophen-3-amine hydrochloride
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3-Chloro-1-benzothiophen-6-amine hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride?
The IUPAC name of 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride (CID 56601035) is 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride.
What is the SMILES notation for 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride?
The canonical SMILES for 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride is Cl.Nc1ccsc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride?
The InChIKey is KWRXCICADFRBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNS.ClH/c11-8-3-1-7(2-4-8)10-9(12)5-6-13-10;/h1-6H,12H2;1H.
What are the key properties of 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride?
2-(4-chlorophenyl)thiophen-3-amine;hydrochloride has a molecular weight of 246.16 g/mol, XLogP of 4.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)thiophen-3-amine;hydrochloride is sourced from PubChem (CID 56601035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).