1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine

C13H19NO — CID 105030225

IUPAC1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine
SMILESNC(Cc1ccoc1)C1C2CCCCC21
InChIInChI=1S/C13H19NO/c14-12(7-9-5-6-15-8-9)13-10-3-1-2-4-11(10)13/h5-6,8,10-13H,1-4,7,14H2
InChIKeyKUCAZFXAXUOMAY-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.59
Rot. Bonds3

About 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine

1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine (PubChem CID 105030225) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine.

Molecular Properties

Compound Name1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine
PubChem CID105030225
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine
SMILESNC(Cc1ccoc1)C1C2CCCCC21
InChIInChI=1S/C13H19NO/c14-12(7-9-5-6-15-8-9)13-10-3-1-2-4-11(10)13/h5-6,8,10-13H,1-4,7,14H2
InChIKeyKUCAZFXAXUOMAY-UHFFFAOYSA-N
XLogP2.59
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4,4-dimethylcyclohexyl)-2-(furan-3-yl)ethanamine
CID 83176155
2-(furan-3-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 105030155
4-cyclohexyl-1-(furan-3-yl)butan-2-amine
CID 105029745
1-(4-tert-butylcyclohexyl)-2-(furan-3-yl)ethanamine
CID 83175246
1-(7-bicyclo[4.1.0]heptanyl)-2-(1-methylpyrazol-4-yl)ethanamine
CID 115822001
1-cyclohexyl-3-(furan-3-yl)propane-1,2-diol
CID 103458978
1-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl)-2-(furan-3-yl)ethanamine
CID 83182256
2-[1-fluoro-2-(furan-3-yl)ethyl]piperidine
CID 106635035
1-cyclopropyl-3-(furan-3-yl)propan-1-amine
CID 64506064
1-cyclobutyl-2-(furan-3-yl)-N-methylethanamine
CID 83175338
[1-cyclopropyl-2-(furan-3-yl)ethyl]hydrazine
CID 105202437
1-(7-bicyclo[4.1.0]heptanyl)-2-(2,6-dichlorophenyl)ethanamine
CID 115830720

Frequently Asked Questions

What is the IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine?
The IUPAC name of 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine (CID 105030225) is 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine.
What is the SMILES notation for 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine?
The canonical SMILES for 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine is NC(Cc1ccoc1)C1C2CCCCC21.
What is the InChIKey of 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine?
The InChIKey is KUCAZFXAXUOMAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-12(7-9-5-6-15-8-9)13-10-3-1-2-4-11(10)13/h5-6,8,10-13H,1-4,7,14H2.
What are the key properties of 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine?
1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bicyclo[4.1.0]heptanyl)-2-(furan-3-yl)ethanamine is sourced from PubChem (CID 105030225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).