2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine

C12H25NO — CID 115021831

IUPAC2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine
SMILESCC(C)(C)OC1(CCN)CCCCC1
InChIInChI=1S/C12H25NO/c1-11(2,3)14-12(9-10-13)7-5-4-6-8-12/h4-10,13H2,1-3H3
InChIKeyFGBBTBUDRYWPQY-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.85
Rot. Bonds3

About 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine

2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine (PubChem CID 115021831) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine.

Molecular Properties

Compound Name2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine
PubChem CID115021831
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine
SMILESCC(C)(C)OC1(CCN)CCCCC1
InChIInChI=1S/C12H25NO/c1-11(2,3)14-12(9-10-13)7-5-4-6-8-12/h4-10,13H2,1-3H3
InChIKeyFGBBTBUDRYWPQY-UHFFFAOYSA-N
XLogP2.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-methoxycycloheptyl)ethanamine
CID 83905895
2-[3-[(2-methylpropan-2-yl)oxy]thiolan-3-yl]ethanamine
CID 115023208
1-[[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]methyl]pyrrolidine
CID 155794361
2-(1-methoxycyclopropyl)ethanamine;hydrochloride
CID 134819042
2-[1-(cyclohexylmethoxy)cyclobutyl]ethanamine
CID 103273986
2-[1-(2,2-dimethylpropyl)cyclohexyl]ethanamine
CID 83818947
2-[1-(2-methylpropoxy)cyclobutyl]ethanamine
CID 103273099
1,1-bis[(2-methylpropan-2-yl)oxy]cyclopentane
CID 153309122
1-[(2-methylpropan-2-yl)oxy]cyclohexane-1-carbaldehyde
CID 115016765
2-(1-phenylmethoxycycloheptyl)ethanamine
CID 115046142
2-(1-methylcyclobutyl)ethanamine;hydrochloride
CID 55284653
2-[1-(2-ethylhexoxy)cyclobutyl]ethanamine
CID 103273222

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine?
The IUPAC name of 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine (CID 115021831) is 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine.
What is the SMILES notation for 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine?
The canonical SMILES for 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine is CC(C)(C)OC1(CCN)CCCCC1.
What is the InChIKey of 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine?
The InChIKey is FGBBTBUDRYWPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-11(2,3)14-12(9-10-13)7-5-4-6-8-12/h4-10,13H2,1-3H3.
What are the key properties of 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine?
2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine has a molecular weight of 199.34 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-methylpropan-2-yl)oxy]cyclohexyl]ethanamine is sourced from PubChem (CID 115021831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).