N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine

C12H24N2O2 — CID 106822250

IUPACN-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine
SMILESCCOC1CC(CN)(N(C)C2CCOC2)C1
InChIInChI=1S/C12H24N2O2/c1-3-16-11-6-12(7-11,9-13)14(2)10-4-5-15-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyZCOPJLYKRMCFRD-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.60
Rot. Bonds5

About N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine

N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine (PubChem CID 106822250) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine
PubChem CID106822250
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine
SMILESCCOC1CC(CN)(N(C)C2CCOC2)C1
InChIInChI=1S/C12H24N2O2/c1-3-16-11-6-12(7-11,9-13)14(2)10-4-5-15-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyZCOPJLYKRMCFRD-UHFFFAOYSA-N
XLogP0.60
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(aminomethyl)-3-ethylcyclopentyl]-N-methyloxolan-3-amine
CID 82734585
4-(aminomethyl)-1-ethyl-N-methyl-N-(oxolan-3-yl)piperidin-4-amine
CID 82735423
1-(aminomethyl)-3-ethoxy-N-ethyl-N-methylcyclobutan-1-amine
CID 106821743
4-(aminomethyl)-N,1,2-trimethyl-N-(oxolan-3-yl)piperidin-4-amine
CID 82734229
N-[3-(aminomethyl)-1,1-dioxothiolan-3-yl]-N-methyloxolan-3-amine
CID 82734241
1-(aminomethyl)-3-ethoxy-N-methyl-N-(oxan-2-ylmethyl)cyclobutan-1-amine
CID 106821874
N-[1-(aminomethyl)cyclohexyl]-N-methyloxan-4-amine
CID 43610982
3-(aminomethyl)-N,2,2,5,5-pentamethyl-N-(oxolan-3-yl)oxolan-3-amine
CID 82734683
ethane;3-ethoxyoxolane
CID 142523367
N-[1-(aminomethyl)-3-methoxycyclobutyl]-N-methylcyclohexanamine
CID 106821681
N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methylaniline
CID 106821670
6-(aminomethyl)-N-cyclopropyl-N-methyl-1,4-dioxepan-6-amine
CID 126981781

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine?
The IUPAC name of N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine (CID 106822250) is N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine.
What is the SMILES notation for N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine?
The canonical SMILES for N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine is CCOC1CC(CN)(N(C)C2CCOC2)C1.
What is the InChIKey of N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine?
The InChIKey is ZCOPJLYKRMCFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-16-11-6-12(7-11,9-13)14(2)10-4-5-15-8-10/h10-11H,3-9,13H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine?
N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine has a molecular weight of 228.34 g/mol, XLogP of 0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-3-ethoxycyclobutyl]-N-methyloxolan-3-amine is sourced from PubChem (CID 106822250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).