[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine

C13H25NO2 — CID 65158471

IUPAC[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
SMILESNCC1(OCCC2CCCO2)CCCCC1
InChIInChI=1S/C13H25NO2/c14-11-13(7-2-1-3-8-13)16-10-6-12-5-4-9-15-12/h12H,1-11,14H2
InChIKeyQVBXJKCRRZSFJO-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.23
Rot. Bonds5

About [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine

[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine (PubChem CID 65158471) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
PubChem CID65158471
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
SMILESNCC1(OCCC2CCCO2)CCCCC1
InChIInChI=1S/C13H25NO2/c14-11-13(7-2-1-3-8-13)16-10-6-12-5-4-9-15-12/h12H,1-11,14H2
InChIKeyQVBXJKCRRZSFJO-UHFFFAOYSA-N
XLogP2.23
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-tert-butyl-1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine
CID 65158713
[1-[3-(oxolan-2-yl)propoxy]-4-propan-2-ylcyclohexyl]methanamine
CID 65158667
[4,4-dimethyl-1-(oxolan-2-ylmethoxy)cyclohexyl]methanamine
CID 65050953
[1-(oxolan-2-ylmethyl)cyclooctyl]methanamine
CID 80603057
[1-(oxolan-2-ylmethoxy)-4-propan-2-ylcyclohexyl]methanamine
CID 62107413
1-(aminomethyl)-N-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexan-1-amine
CID 65158615
[3-methyl-1-(oxolan-2-ylmethoxy)cyclopentyl]methanamine
CID 65051674
1-[2-(oxolan-2-yl)ethyl]cycloheptan-1-ol
CID 65162275
N-[[1-(oxolan-2-ylmethoxy)cycloheptyl]methyl]cyclopropanamine
CID 55036625
N-[[1-(oxolan-2-ylmethoxy)cyclohexyl]methyl]cyclopropanamine
CID 62107940
1-(aminomethyl)-N-ethyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 61433810
[1-(cyclohexylmethoxy)cyclohexyl]methanamine
CID 62383521

Frequently Asked Questions

What is the IUPAC name of [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine?
The IUPAC name of [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine (CID 65158471) is [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine.
What is the SMILES notation for [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine?
The canonical SMILES for [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine is NCC1(OCCC2CCCO2)CCCCC1.
What is the InChIKey of [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine?
The InChIKey is QVBXJKCRRZSFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c14-11-13(7-2-1-3-8-13)16-10-6-12-5-4-9-15-12/h12H,1-11,14H2.
What are the key properties of [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine?
[1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine has a molecular weight of 227.35 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(oxolan-2-yl)ethoxy]cyclohexyl]methanamine is sourced from PubChem (CID 65158471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).