2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine

C14H27NO2 — CID 103274121

IUPAC2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine
SMILESCNCCC1(OC2CCCC(OC)C2)CCC1
InChIInChI=1S/C14H27NO2/c1-15-10-9-14(7-4-8-14)17-13-6-3-5-12(11-13)16-2/h12-13,15H,3-11H2,1-2H3
InChIKeyVDESNOHAXWHZBC-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.49
Rot. Bonds6

About 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine

2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine (PubChem CID 103274121) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine.

Molecular Properties

Compound Name2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine
PubChem CID103274121
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine
SMILESCNCCC1(OC2CCCC(OC)C2)CCC1
InChIInChI=1S/C14H27NO2/c1-15-10-9-14(7-4-8-14)17-13-6-3-5-12(11-13)16-2/h12-13,15H,3-11H2,1-2H3
InChIKeyVDESNOHAXWHZBC-UHFFFAOYSA-N
XLogP2.49
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[1-(oxetan-3-yloxy)cyclobutyl]ethanamine
CID 103274520
N-methyl-2-[1-(2-methylcyclohexyl)oxycyclobutyl]ethanamine
CID 103273091
N-[2-(1-cyclopentyloxycyclobutyl)ethyl]cyclopropanamine
CID 103273019
N-methyl-2-[1-[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)oxy]cyclobutyl]ethanamine
CID 103274274
N-[2-(1-cyclohexyloxycyclobutyl)ethyl]-2-methylpropan-1-amine
CID 103273010
N'-[2-(1-methoxycyclobutyl)ethyl]-N-methylethane-1,2-diamine
CID 103556559
1-(1-cycloheptyloxycyclohexyl)-N-methylmethanamine
CID 62110565
N-methyl-2-(1-prop-2-enoxycyclobutyl)ethanamine
CID 103272994
2-[1-[2-(dimethylamino)ethoxy]cyclobutyl]-N-methylethanamine
CID 103273658
N-methyl-2-[1-(oxolan-3-ylmethoxy)cyclobutyl]ethanamine
CID 103273960
(3-methoxycyclohexyl) 1-aminocyclobutane-1-carboxylate
CID 81161404
[1-(3-methylcyclohexyl)oxycyclopentyl]methanamine
CID 62111227

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine?
The IUPAC name of 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine (CID 103274121) is 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine.
What is the SMILES notation for 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine?
The canonical SMILES for 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine is CNCCC1(OC2CCCC(OC)C2)CCC1.
What is the InChIKey of 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine?
The InChIKey is VDESNOHAXWHZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-15-10-9-14(7-4-8-14)17-13-6-3-5-12(11-13)16-2/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine?
2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine has a molecular weight of 241.37 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-methoxycyclohexyl)oxycyclobutyl]-N-methylethanamine is sourced from PubChem (CID 103274121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).