1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine

C16H31NO — CID 104748736

IUPAC1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine
SMILESCCC1CCCCC1OCC(N)C1CCCCC1
InChIInChI=1S/C16H31NO/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h13-16H,2-12,17H2,1H3
InChIKeyKTJUZLZQYJTIKN-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.88
Rot. Bonds5

About 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine

1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine (PubChem CID 104748736) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine.

Molecular Properties

Compound Name1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine
PubChem CID104748736
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine
SMILESCCC1CCCCC1OCC(N)C1CCCCC1
InChIInChI=1S/C16H31NO/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h13-16H,2-12,17H2,1H3
InChIKeyKTJUZLZQYJTIKN-UHFFFAOYSA-N
XLogP3.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(bromomethyl)butoxy]-2-ethylcyclohexane
CID 64994566
1-(cyclohexylmethylamino)-3-(2-ethylcyclohexyl)oxypropan-2-ol
CID 60633455
2-[(2-ethylcyclohexyl)oxymethyl]-3,3,3-trifluoropropanimidamide
CID 103370926
2-[(2-ethylcyclohexyl)oxymethyl]-3,3,3-trifluoropropanethioamide
CID 103369046
2-(2-ethylcyclohexyl)oxy-1-(oxolan-3-yl)ethanol
CID 104753532
(2-ethylcyclohexyl) 2-aminopropanoate
CID 61277036
1-(3-bromopropoxy)-2-ethylcyclohexane
CID 43135438
1-(2-ethylcyclohexyl)oxy-3-(methoxyamino)propan-2-ol
CID 60702585
1-[(2-ethylcyclohexyl)oxymethyl]cyclohexan-1-amine
CID 64574195
2-(2-ethylcyclohexyl)oxy-N-methyl-1-(oxolan-3-yl)ethanamine
CID 104748738
2-[(2-ethylcyclohexyl)oxymethyl]-3,3,3-trifluoropropanenitrile
CID 103368274
2-(2-ethylcyclohexyl)oxycycloheptan-1-amine
CID 60725474

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine?
The IUPAC name of 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine (CID 104748736) is 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine.
What is the SMILES notation for 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine?
The canonical SMILES for 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine is CCC1CCCCC1OCC(N)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine?
The InChIKey is KTJUZLZQYJTIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-2-13-8-6-7-11-16(13)18-12-15(17)14-9-4-3-5-10-14/h13-16H,2-12,17H2,1H3.
What are the key properties of 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine?
1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine has a molecular weight of 253.43 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine is sourced from PubChem (CID 104748736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).