1-(furan-3-yl)ethanamine;hydrochloride

C6H10ClNO — CID 71756511

IUPAC1-(furan-3-yl)ethanamine;hydrochloride
SMILESCC(N)c1ccoc1.Cl
InChIInChI=1S/C6H9NO.ClH/c1-5(7)6-2-3-8-4-6;/h2-5H,7H2,1H3;1H
InChIKeyVAUYLMGGLPAIED-UHFFFAOYSA-N
MW147.61 g/mol
LogP1.72
Rot. Bonds1

About 1-(furan-3-yl)ethanamine;hydrochloride

1-(furan-3-yl)ethanamine;hydrochloride (PubChem CID 71756511) has the molecular formula C6H10ClNO and a molecular weight of 147.61 g/mol. Its IUPAC name is 1-(furan-3-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name1-(furan-3-yl)ethanamine;hydrochloride
PubChem CID71756511
Molecular FormulaC6H10ClNO
Molecular Weight147.61 g/mol
Exact Mass147.05
IUPAC Name1-(furan-3-yl)ethanamine;hydrochloride
SMILESCC(N)c1ccoc1.Cl
InChIInChI=1S/C6H9NO.ClH/c1-5(7)6-2-3-8-4-6;/h2-5H,7H2,1H3;1H
InChIKeyVAUYLMGGLPAIED-UHFFFAOYSA-N
XLogP1.72
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.61
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Furan-3-yl)ethanamine
CID 11804704
2-(Furan-3-yl)ethan-1-amine
CID 15721844
1-(2-Methylfuran-3-yl)methanamine
CID 18525866
2-Furan-3-yl-allylamine
CID 13583280
1-(Furan-3-yl)methanamine hydrochloride
CID 2795087
1-(2,5-Dimethylfuran-3-yl)ethan-1-amine
CID 16768211
(5-Methylfuran-3-yl)methanamine
CID 55288815
(R)-1-(Furan-3-yl)ethan-1-amine hydrochloride
CID 137832506
(1S)-1-(furan-3-yl)ethan-1-amine hydrochloride
CID 137832513
Methyl 2-amino-2-(furan-3-yl)acetate hydrochloride
CID 165479149
1-[2-(Trifluoromethyl)furan-3-yl]methanaminehydrochloride
CID 165691150
1-(3-furyl)-N-methylethanamine
CID 4715036

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)ethanamine;hydrochloride?
The IUPAC name of 1-(furan-3-yl)ethanamine;hydrochloride (CID 71756511) is 1-(furan-3-yl)ethanamine;hydrochloride.
What is the SMILES notation for 1-(furan-3-yl)ethanamine;hydrochloride?
The canonical SMILES for 1-(furan-3-yl)ethanamine;hydrochloride is CC(N)c1ccoc1.Cl.
What is the InChIKey of 1-(furan-3-yl)ethanamine;hydrochloride?
The InChIKey is VAUYLMGGLPAIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.ClH/c1-5(7)6-2-3-8-4-6;/h2-5H,7H2,1H3;1H.
What are the key properties of 1-(furan-3-yl)ethanamine;hydrochloride?
1-(furan-3-yl)ethanamine;hydrochloride has a molecular weight of 147.61 g/mol, XLogP of 1.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)ethanamine;hydrochloride is sourced from PubChem (CID 71756511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).