2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine

C11H17NO2 — CID 116722206

IUPAC2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine
SMILESCNC(c1ccoc1)C(OC)C1CC1
InChIInChI=1S/C11H17NO2/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3
InChIKeyHKDCVJXKCVZBTL-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.97
Rot. Bonds5

About 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine

2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine (PubChem CID 116722206) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine
PubChem CID116722206
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine
SMILESCNC(c1ccoc1)C(OC)C1CC1
InChIInChI=1S/C11H17NO2/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3
InChIKeyHKDCVJXKCVZBTL-UHFFFAOYSA-N
XLogP1.97
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine?
The IUPAC name of 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine (CID 116722206) is 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine?
The canonical SMILES for 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine is CNC(c1ccoc1)C(OC)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine?
The InChIKey is HKDCVJXKCVZBTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-12-10(9-5-6-14-7-9)11(13-2)8-3-4-8/h5-8,10-12H,3-4H2,1-2H3.
What are the key properties of 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine?
2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine has a molecular weight of 195.26 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(furan-3-yl)-2-methoxy-N-methylethanamine is sourced from PubChem (CID 116722206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).