[1-(ethoxymethyl)cyclohexyl]methanamine

C10H21NO — CID 103984440

IUPAC[1-(ethoxymethyl)cyclohexyl]methanamine
SMILESCCOCC1(CN)CCCCC1
InChIInChI=1S/C10H21NO/c1-2-12-9-10(8-11)6-4-3-5-7-10/h2-9,11H2,1H3
InChIKeyXNSZVRFWTAMLIR-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds4

About [1-(ethoxymethyl)cyclohexyl]methanamine

[1-(ethoxymethyl)cyclohexyl]methanamine (PubChem CID 103984440) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is [1-(ethoxymethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(ethoxymethyl)cyclohexyl]methanamine
PubChem CID103984440
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name[1-(ethoxymethyl)cyclohexyl]methanamine
SMILESCCOCC1(CN)CCCCC1
InChIInChI=1S/C10H21NO/c1-2-12-9-10(8-11)6-4-3-5-7-10/h2-9,11H2,1H3
InChIKeyXNSZVRFWTAMLIR-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(ethoxymethyl)cyclohexyl]methanamine?
The IUPAC name of [1-(ethoxymethyl)cyclohexyl]methanamine (CID 103984440) is [1-(ethoxymethyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(ethoxymethyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(ethoxymethyl)cyclohexyl]methanamine is CCOCC1(CN)CCCCC1.
What is the InChIKey of [1-(ethoxymethyl)cyclohexyl]methanamine?
The InChIKey is XNSZVRFWTAMLIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-12-9-10(8-11)6-4-3-5-7-10/h2-9,11H2,1H3.
What are the key properties of [1-(ethoxymethyl)cyclohexyl]methanamine?
[1-(ethoxymethyl)cyclohexyl]methanamine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(ethoxymethyl)cyclohexyl]methanamine is sourced from PubChem (CID 103984440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).