2-(furan-2-yl)ethanamine;hydrochloride

C6H10ClNO — CID 13045548

IUPAC2-(furan-2-yl)ethanamine;hydrochloride
SMILESCl.NCCc1ccco1
InChIInChI=1S/C6H9NO.ClH/c7-4-3-6-2-1-5-8-6;/h1-2,5H,3-4,7H2;1H
InChIKeyWDQHIUNKANIJFJ-UHFFFAOYSA-N
MW147.61 g/mol
LogP1.20
Rot. Bonds2

About 2-(furan-2-yl)ethanamine;hydrochloride

2-(furan-2-yl)ethanamine;hydrochloride (PubChem CID 13045548) has the molecular formula C6H10ClNO and a molecular weight of 147.61 g/mol. Its IUPAC name is 2-(furan-2-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(furan-2-yl)ethanamine;hydrochloride
PubChem CID13045548
Molecular FormulaC6H10ClNO
Molecular Weight147.61 g/mol
Exact Mass147.05
IUPAC Name2-(furan-2-yl)ethanamine;hydrochloride
SMILESCl.NCCc1ccco1
InChIInChI=1S/C6H9NO.ClH/c7-4-3-6-2-1-5-8-6;/h1-2,5H,3-4,7H2;1H
InChIKeyWDQHIUNKANIJFJ-UHFFFAOYSA-N
XLogP1.20
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.61
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(furan-2-yl)ethanamine;hydrochloride (CID 13045548) is 2-(furan-2-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(furan-2-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(furan-2-yl)ethanamine;hydrochloride is Cl.NCCc1ccco1.
What is the InChIKey of 2-(furan-2-yl)ethanamine;hydrochloride?
The InChIKey is WDQHIUNKANIJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.ClH/c7-4-3-6-2-1-5-8-6;/h1-2,5H,3-4,7H2;1H.
What are the key properties of 2-(furan-2-yl)ethanamine;hydrochloride?
2-(furan-2-yl)ethanamine;hydrochloride has a molecular weight of 147.61 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)ethanamine;hydrochloride is sourced from PubChem (CID 13045548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).