2-phenylthiophen-3-amine;hydrochloride

C10H10ClNS — CID 154853259

IUPAC2-phenylthiophen-3-amine;hydrochloride
SMILESCl.Nc1ccsc1-c1ccccc1
InChIInChI=1S/C10H9NS.ClH/c11-9-6-7-12-10(9)8-4-2-1-3-5-8;/h1-7H,11H2;1H
InChIKeyDUPNMEVTKTWJHP-UHFFFAOYSA-N
MW211.72 g/mol
LogP3.42
Rot. Bonds1

About 2-phenylthiophen-3-amine;hydrochloride

2-phenylthiophen-3-amine;hydrochloride (PubChem CID 154853259) has the molecular formula C10H10ClNS and a molecular weight of 211.72 g/mol. Its IUPAC name is 2-phenylthiophen-3-amine;hydrochloride.

Molecular Properties

Compound Name2-phenylthiophen-3-amine;hydrochloride
PubChem CID154853259
Molecular FormulaC10H10ClNS
Molecular Weight211.72 g/mol
Exact Mass211.02
IUPAC Name2-phenylthiophen-3-amine;hydrochloride
SMILESCl.Nc1ccsc1-c1ccccc1
InChIInChI=1S/C10H9NS.ClH/c11-9-6-7-12-10(9)8-4-2-1-3-5-8;/h1-7H,11H2;1H
InChIKeyDUPNMEVTKTWJHP-UHFFFAOYSA-N
XLogP3.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.72
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenylthiophen-3-amine;hydrochloride?
The IUPAC name of 2-phenylthiophen-3-amine;hydrochloride (CID 154853259) is 2-phenylthiophen-3-amine;hydrochloride.
What is the SMILES notation for 2-phenylthiophen-3-amine;hydrochloride?
The canonical SMILES for 2-phenylthiophen-3-amine;hydrochloride is Cl.Nc1ccsc1-c1ccccc1.
What is the InChIKey of 2-phenylthiophen-3-amine;hydrochloride?
The InChIKey is DUPNMEVTKTWJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NS.ClH/c11-9-6-7-12-10(9)8-4-2-1-3-5-8;/h1-7H,11H2;1H.
What are the key properties of 2-phenylthiophen-3-amine;hydrochloride?
2-phenylthiophen-3-amine;hydrochloride has a molecular weight of 211.72 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylthiophen-3-amine;hydrochloride is sourced from PubChem (CID 154853259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).