5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine

C12H25NO2 — CID 103559873

IUPAC5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine
SMILESCOCCC(C)C(N)CC1(OC)CCC1
InChIInChI=1S/C12H25NO2/c1-10(5-8-14-2)11(13)9-12(15-3)6-4-7-12/h10-11H,4-9,13H2,1-3H3
InChIKeyQDXMDJVUVWPULV-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.95
Rot. Bonds7

About 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine

5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine (PubChem CID 103559873) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine.

Molecular Properties

Compound Name5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine
PubChem CID103559873
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine
SMILESCOCCC(C)C(N)CC1(OC)CCC1
InChIInChI=1S/C12H25NO2/c1-10(5-8-14-2)11(13)9-12(15-3)6-4-7-12/h10-11H,4-9,13H2,1-3H3
InChIKeyQDXMDJVUVWPULV-UHFFFAOYSA-N
XLogP1.95
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-3-(1-methoxycyclobutyl)propan-2-amine
CID 103559585
4-methoxy-1-(1-methoxycycloheptyl)-2-methylbutan-1-amine
CID 116770014
4-methoxy-1-(1-methoxy-4,4-dimethylcyclohexyl)-2-methylbutan-1-amine
CID 116769240
1-(4-methoxybutan-2-yl)cyclobutan-1-amine
CID 116500171
[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
CID 107896000
[4-methoxy-2-methyl-1-(1-methylcyclopentyl)butyl]hydrazine
CID 105337921
1-methoxy-3,6-dimethyloctan-4-amine
CID 105044592
[1-(4-methoxybutan-2-yl)cyclobutyl]methanol
CID 116500225
(1-methoxycyclobutyl)methanamine
CID 66072375
7-ethoxy-1-methoxy-3-methylheptan-4-amine
CID 105185117
4-methoxy-1-(1-methoxycycloheptyl)-N,2-dimethylbutan-1-amine
CID 116770246
1-(2,3-difluoro-4-methylphenyl)-2-(1-methoxycyclobutyl)ethanamine
CID 107515843

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine?
The IUPAC name of 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine (CID 103559873) is 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine.
What is the SMILES notation for 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine?
The canonical SMILES for 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine is COCCC(C)C(N)CC1(OC)CCC1.
What is the InChIKey of 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine?
The InChIKey is QDXMDJVUVWPULV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-10(5-8-14-2)11(13)9-12(15-3)6-4-7-12/h10-11H,4-9,13H2,1-3H3.
What are the key properties of 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine?
5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine has a molecular weight of 215.34 g/mol, XLogP of 1.95, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-(1-methoxycyclobutyl)-3-methylpentan-2-amine is sourced from PubChem (CID 103559873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).