N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine

C12H23NO2 — CID 176568568

IUPACN-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine
SMILESCCN(CC1(COC)CC1)C1CCOC1
InChIInChI=1S/C12H23NO2/c1-3-13(11-4-7-15-8-11)9-12(5-6-12)10-14-2/h11H,3-10H2,1-2H3
InChIKeyDEIAZKVMSPTKIM-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.52
Rot. Bonds6

About N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine

N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine (PubChem CID 176568568) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine
PubChem CID176568568
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine
SMILESCCN(CC1(COC)CC1)C1CCOC1
InChIInChI=1S/C12H23NO2/c1-3-13(11-4-7-15-8-11)9-12(5-6-12)10-14-2/h11H,3-10H2,1-2H3
InChIKeyDEIAZKVMSPTKIM-UHFFFAOYSA-N
XLogP1.52
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine?
The IUPAC name of N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine (CID 176568568) is N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine.
What is the SMILES notation for N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine?
The canonical SMILES for N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine is CCN(CC1(COC)CC1)C1CCOC1.
What is the InChIKey of N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine?
The InChIKey is DEIAZKVMSPTKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-13(11-4-7-15-8-11)9-12(5-6-12)10-14-2/h11H,3-10H2,1-2H3.
What are the key properties of N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine?
N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine has a molecular weight of 213.32 g/mol, XLogP of 1.52, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[1-(methoxymethyl)cyclopropyl]methyl]oxolan-3-amine is sourced from PubChem (CID 176568568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).