2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine

C18H29NO2 — CID 116771624

IUPAC2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine
SMILESCNC(c1ccc(OC)cc1C)C(OC)C1CCCCC1
InChIInChI=1S/C18H29NO2/c1-13-12-15(20-3)10-11-16(13)17(19-2)18(21-4)14-8-6-5-7-9-14/h10-12,14,17-19H,5-9H2,1-4H3
InChIKeyABGLDDZXKMNUBT-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.86
Rot. Bonds6

About 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine

2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine (PubChem CID 116771624) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine
PubChem CID116771624
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine
SMILESCNC(c1ccc(OC)cc1C)C(OC)C1CCCCC1
InChIInChI=1S/C18H29NO2/c1-13-12-15(20-3)10-11-16(13)17(19-2)18(21-4)14-8-6-5-7-9-14/h10-12,14,17-19H,5-9H2,1-4H3
InChIKeyABGLDDZXKMNUBT-UHFFFAOYSA-N
XLogP3.86
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-1-(4-fluoro-2-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771486
2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
CID 116771562
1-cycloheptyl-1-(4-methoxy-2-methylphenyl)-N-methylmethanamine
CID 55091680
2-cyclohexyl-1-(2,3-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771448
2-cyclohexyl-1-(3,4-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771600
1-(4-methoxy-2-methylphenyl)-N,2-dimethylpropan-1-amine
CID 43482752
2-cyclopropyl-N-ethyl-1-(4-methoxy-2-methylphenyl)propan-1-amine
CID 83153801
[2-cyclopropyl-2-ethoxy-1-(4-methoxy-2-methylphenyl)ethyl]hydrazine
CID 105273244
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-cyclopropyl-1-(2-fluoro-4-methoxyphenyl)-N-methylpropan-1-amine
CID 83154390
N-cyclohexyl-4-methoxy-2-methylaniline
CID 62867173

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine?
The IUPAC name of 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine (CID 116771624) is 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine?
The canonical SMILES for 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine is CNC(c1ccc(OC)cc1C)C(OC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine?
The InChIKey is ABGLDDZXKMNUBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-13-12-15(20-3)10-11-16(13)17(19-2)18(21-4)14-8-6-5-7-9-14/h10-12,14,17-19H,5-9H2,1-4H3.
What are the key properties of 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine?
2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine has a molecular weight of 291.44 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine is sourced from PubChem (CID 116771624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).