2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine

C14H29NO2 — CID 116767121

IUPAC2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine
SMILESCCOCC(NC)C1(OCC)CCC(C)CC1
InChIInChI=1S/C14H29NO2/c1-5-16-11-13(15-4)14(17-6-2)9-7-12(3)8-10-14/h12-13,15H,5-11H2,1-4H3
InChIKeyGCAKOKGFDSCMTC-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.60
Rot. Bonds7

About 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine

2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine (PubChem CID 116767121) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine.

Molecular Properties

Compound Name2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine
PubChem CID116767121
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine
SMILESCCOCC(NC)C1(OCC)CCC(C)CC1
InChIInChI=1S/C14H29NO2/c1-5-16-11-13(15-4)14(17-6-2)9-7-12(3)8-10-14/h12-13,15H,5-11H2,1-4H3
InChIKeyGCAKOKGFDSCMTC-UHFFFAOYSA-N
XLogP2.60
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethoxy-4-methylcyclohexyl)-N,4-dimethylpentan-1-amine
CID 116767108
1-[2-ethoxy-1-(methylamino)ethyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79570647
1-(1-ethoxy-4-methylcyclohexyl)-N,2-dimethylbutan-1-amine
CID 116767228
1-(1-ethoxy-4-methylcyclohexyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 116767242
1-(1-ethoxy-4-methylcyclohexyl)-1-(4-ethylcyclohexyl)-N-methylmethanamine
CID 116767209
1-(1-ethoxy-4-methylcyclohexyl)-2-(2-fluorophenyl)-N-methylethanamine
CID 116767103
1-(1-ethoxy-4-methylcyclohexyl)-N-ethyl-3-methylbutan-1-amine
CID 116767273
1-(1-ethoxy-3-methylcyclohexyl)-2-methoxy-N-methylethanamine
CID 116768285
N-[cyclopropyl-(1-ethoxy-4-methylcyclohexyl)methyl]ethanamine
CID 116767361
N-[2-cyclopropyl-1-(1-ethoxy-4-methylcyclohexyl)ethyl]propan-1-amine
CID 116767388
1-(1-ethoxy-4-methylcyclohexyl)-N-methyl-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 116767135
[1-(1-ethoxy-4-methylcyclohexyl)-3-methylpentyl]hydrazine
CID 105277364

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine?
The IUPAC name of 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine (CID 116767121) is 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine.
What is the SMILES notation for 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine?
The canonical SMILES for 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine is CCOCC(NC)C1(OCC)CCC(C)CC1.
What is the InChIKey of 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine?
The InChIKey is GCAKOKGFDSCMTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-5-16-11-13(15-4)14(17-6-2)9-7-12(3)8-10-14/h12-13,15H,5-11H2,1-4H3.
What are the key properties of 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine?
2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine has a molecular weight of 243.39 g/mol, XLogP of 2.60, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(1-ethoxy-4-methylcyclohexyl)-N-methylethanamine is sourced from PubChem (CID 116767121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).