2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine

C19H31NO — CID 116771562

IUPAC2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
SMILESCNC(c1cc(C)c(C)cc1C)C(OC)C1CCCCC1
InChIInChI=1S/C19H31NO/c1-13-11-15(3)17(12-14(13)2)18(20-4)19(21-5)16-9-7-6-8-10-16/h11-12,16,18-20H,6-10H2,1-5H3
InChIKeyGFHLCTDYGBIFLE-UHFFFAOYSA-N
MW289.46 g/mol
LogP4.47
Rot. Bonds5

About 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine

2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine (PubChem CID 116771562) has the molecular formula C19H31NO and a molecular weight of 289.46 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
PubChem CID116771562
Molecular FormulaC19H31NO
Molecular Weight289.46 g/mol
Exact Mass289.24
IUPAC Name2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
SMILESCNC(c1cc(C)c(C)cc1C)C(OC)C1CCCCC1
InChIInChI=1S/C19H31NO/c1-13-11-15(3)17(12-14(13)2)18(20-4)19(21-5)16-9-7-6-8-10-16/h11-12,16,18-20H,6-10H2,1-5H3
InChIKeyGFHLCTDYGBIFLE-UHFFFAOYSA-N
XLogP4.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.46
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine
CID 116771624
2-cyclohexyl-1-(4-fluoro-2-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771486
2-cyclohexyl-1-(3,4-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771600
2-cyclohexyl-1-(2,3-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771448
2-cyclohexyl-1-(3-fluoro-5-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771626
2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 116771590
2,2-dimethoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
CID 79492540
2-cyclohexyl-1-(3,4-dimethylphenyl)-N-ethyl-2-methoxyethanamine
CID 116771781
2-cyclohexyl-2-methoxy-N-methyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 116771490
1,2-dicyclohexyl-2-methoxy-N-methylethanamine
CID 116771418
1-(2-chlorophenyl)-2-cyclopropyl-2-methoxy-N-methylethanamine
CID 116722168
[2-cyclohexyl-2-methoxy-1-(2-methylthiophen-3-yl)ethyl]hydrazine
CID 102843105

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine?
The IUPAC name of 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine (CID 116771562) is 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine is CNC(c1cc(C)c(C)cc1C)C(OC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine?
The InChIKey is GFHLCTDYGBIFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO/c1-13-11-15(3)17(12-14(13)2)18(20-4)19(21-5)16-9-7-6-8-10-16/h11-12,16,18-20H,6-10H2,1-5H3.
What are the key properties of 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine?
2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine has a molecular weight of 289.46 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine is sourced from PubChem (CID 116771562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).