2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine

C11H17NO2 — CID 62599394

IUPAC2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine
SMILESc1coc(CNCCOCC2CC2)c1
InChIInChI=1S/C11H17NO2/c1-2-11(14-6-1)8-12-5-7-13-9-10-3-4-10/h1-2,6,10,12H,3-5,7-9H2
InChIKeyIVAKDRKICHDKJD-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.80
Rot. Bonds7

About 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine

2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine (PubChem CID 62599394) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine
PubChem CID62599394
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine
SMILESc1coc(CNCCOCC2CC2)c1
InChIInChI=1S/C11H17NO2/c1-2-11(14-6-1)8-12-5-7-13-9-10-3-4-10/h1-2,6,10,12H,3-5,7-9H2
InChIKeyIVAKDRKICHDKJD-UHFFFAOYSA-N
XLogP1.80
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine?
The IUPAC name of 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine (CID 62599394) is 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine is c1coc(CNCCOCC2CC2)c1.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine?
The InChIKey is IVAKDRKICHDKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-2-11(14-6-1)8-12-5-7-13-9-10-3-4-10/h1-2,6,10,12H,3-5,7-9H2.
What are the key properties of 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine?
2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine has a molecular weight of 195.26 g/mol, XLogP of 1.80, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)ethanamine is sourced from PubChem (CID 62599394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).