3-ethyl-1-(methoxymethyl)cyclohexan-1-amine

C10H21NO — CID 126977495

IUPAC3-ethyl-1-(methoxymethyl)cyclohexan-1-amine
SMILESCCC1CCCC(N)(COC)C1
InChIInChI=1S/C10H21NO/c1-3-9-5-4-6-10(11,7-9)8-12-2/h9H,3-8,11H2,1-2H3
InChIKeyKPKQAGFXRLXZMF-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds3

About 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine

3-ethyl-1-(methoxymethyl)cyclohexan-1-amine (PubChem CID 126977495) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(methoxymethyl)cyclohexan-1-amine
PubChem CID126977495
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3-ethyl-1-(methoxymethyl)cyclohexan-1-amine
SMILESCCC1CCCC(N)(COC)C1
InChIInChI=1S/C10H21NO/c1-3-9-5-4-6-10(11,7-9)8-12-2/h9H,3-8,11H2,1-2H3
InChIKeyKPKQAGFXRLXZMF-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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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Related Compounds

1-[(1-aminocyclohexyl)methyl]-3-ethylcyclohexan-1-amine
CID 54557959
3-ethyl-1-(2-propan-2-ylsulfonylethyl)cyclohexan-1-amine
CID 106734170
[3-ethyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexyl]methanamine
CID 104568544
3-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
CID 112642173
[(1R,3R)-3-ethyl-1-methylcyclohexyl]methanamine
CID 124509465
3-ethyl-1-(3-methoxypropyl)cyclohexan-1-ol
CID 114852220
1-[(3-ethylcyclohexyl)oxymethyl]cyclohexan-1-amine
CID 64571862
(1-ethoxy-3-ethylcyclohexyl)methanamine
CID 66072990
2-(1-amino-3-ethylcyclopentyl)ethanol
CID 65239857
3-ethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]cyclohexan-1-amine
CID 103007094
3-ethyl-1-[(4-nitrophenyl)methyl]cyclohexan-1-amine
CID 65422470
1-[(4-chloro-3-fluorophenyl)methyl]-3-ethylcyclohexan-1-amine
CID 114012587

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine?
The IUPAC name of 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine (CID 126977495) is 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine.
What is the SMILES notation for 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine?
The canonical SMILES for 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine is CCC1CCCC(N)(COC)C1.
What is the InChIKey of 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine?
The InChIKey is KPKQAGFXRLXZMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-9-5-4-6-10(11,7-9)8-12-2/h9H,3-8,11H2,1-2H3.
What are the key properties of 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine?
3-ethyl-1-(methoxymethyl)cyclohexan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(methoxymethyl)cyclohexan-1-amine is sourced from PubChem (CID 126977495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).