N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine

C11H21NO2 — CID 62444292

IUPACN-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine
SMILESCCOCC1CCC(CNC2CC2)O1
InChIInChI=1S/C11H21NO2/c1-2-13-8-11-6-5-10(14-11)7-12-9-3-4-9/h9-12H,2-8H2,1H3
InChIKeyVKPPMVLUXMKQDA-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds6

About N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine

N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine (PubChem CID 62444292) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine
PubChem CID62444292
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine
SMILESCCOCC1CCC(CNC2CC2)O1
InChIInChI=1S/C11H21NO2/c1-2-13-8-11-6-5-10(14-11)7-12-9-3-4-9/h9-12H,2-8H2,1H3
InChIKeyVKPPMVLUXMKQDA-UHFFFAOYSA-N
XLogP1.32
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine (CID 62444292) is N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine is CCOCC1CCC(CNC2CC2)O1.
What is the InChIKey of N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine?
The InChIKey is VKPPMVLUXMKQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-2-13-8-11-6-5-10(14-11)7-12-9-3-4-9/h9-12H,2-8H2,1H3.
What are the key properties of N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine?
N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine has a molecular weight of 199.29 g/mol, XLogP of 1.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(ethoxymethyl)oxolan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62444292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).