2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol

C11H17NO2 — CID 115882339

IUPAC2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol
SMILESOCCN(Cc1ccoc1)CC1CC1
InChIInChI=1S/C11H17NO2/c13-5-4-12(7-10-1-2-10)8-11-3-6-14-9-11/h3,6,9-10,13H,1-2,4-5,7-8H2
InChIKeyNMFOLZZRCNTEJC-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.48
Rot. Bonds6

About 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol

2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol (PubChem CID 115882339) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol
PubChem CID115882339
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol
SMILESOCCN(Cc1ccoc1)CC1CC1
InChIInChI=1S/C11H17NO2/c13-5-4-12(7-10-1-2-10)8-11-3-6-14-9-11/h3,6,9-10,13H,1-2,4-5,7-8H2
InChIKeyNMFOLZZRCNTEJC-UHFFFAOYSA-N
XLogP1.48
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol?
The IUPAC name of 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol (CID 115882339) is 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol is OCCN(Cc1ccoc1)CC1CC1.
What is the InChIKey of 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol?
The InChIKey is NMFOLZZRCNTEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c13-5-4-12(7-10-1-2-10)8-11-3-6-14-9-11/h3,6,9-10,13H,1-2,4-5,7-8H2.
What are the key properties of 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol?
2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol has a molecular weight of 195.26 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethyl(furan-3-ylmethyl)amino]ethanol is sourced from PubChem (CID 115882339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).