1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine

C16H25NO — CID 54980091

IUPAC1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(OC)cc1)C1CCCCC1
InChIInChI=1S/C16H25NO/c1-17-16(14-6-4-3-5-7-14)12-13-8-10-15(18-2)11-9-13/h8-11,14,16-17H,3-7,12H2,1-2H3
InChIKeyXUCDPDPEYBJDCU-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.41
Rot. Bonds5

About 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine

1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine (PubChem CID 54980091) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine
PubChem CID54980091
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(OC)cc1)C1CCCCC1
InChIInChI=1S/C16H25NO/c1-17-16(14-6-4-3-5-7-14)12-13-8-10-15(18-2)11-9-13/h8-11,14,16-17H,3-7,12H2,1-2H3
InChIKeyXUCDPDPEYBJDCU-UHFFFAOYSA-N
XLogP3.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine
CID 65445325
1-cyclohexyl-2-(3-methoxyphenyl)-N-methylethanamine
CID 61066272
1-cycloheptyl-2-(4-fluorophenyl)-N-methylethanamine
CID 55091488
1-cyclohexyl-N-[1-(4-methoxyphenyl)propan-2-yl]propan-1-amine
CID 63476458
1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 63413394
[1-bromo-2-(4-methoxyphenyl)ethyl]cyclooctane
CID 65020671
1-(2,2-dimethylcyclohexyl)-2-(4-methoxyphenyl)-N-methylethanamine
CID 107179500
N-[1-(4-methoxyphenyl)propan-2-yl]cycloheptanamine
CID 2846450
1-(2-bromo-2-cyclobutylethyl)-4-methoxybenzene
CID 63017637
1-(2-bromo-3-cyclohexylpropyl)-4-methoxybenzene
CID 63544491
N-[(4-methoxyphenyl)methyl]cycloheptanamine
CID 784052
1-cyclooctyl-3-(4-methoxyphenyl)propan-1-ol
CID 80603730

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine?
The IUPAC name of 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine (CID 54980091) is 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine is CNC(Cc1ccc(OC)cc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine?
The InChIKey is XUCDPDPEYBJDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-17-16(14-6-4-3-5-7-14)12-13-8-10-15(18-2)11-9-13/h8-11,14,16-17H,3-7,12H2,1-2H3.
What are the key properties of 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine?
1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine has a molecular weight of 247.38 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 54980091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).