N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine

C20H33N — CID 63415653

IUPACN-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine
SMILESCCNC(Cc1c(C)cc(C)cc1C)C1CCC(C)CC1
InChIInChI=1S/C20H33N/c1-6-21-20(18-9-7-14(2)8-10-18)13-19-16(4)11-15(3)12-17(19)5/h11-12,14,18,20-21H,6-10,13H2,1-5H3
InChIKeyOQGOZRKSTZKWTF-UHFFFAOYSA-N
MW287.49 g/mol
LogP4.96
Rot. Bonds5

About N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine

N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine (PubChem CID 63415653) has the molecular formula C20H33N and a molecular weight of 287.49 g/mol. Its IUPAC name is N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine
PubChem CID63415653
Molecular FormulaC20H33N
Molecular Weight287.49 g/mol
Exact Mass287.26
IUPAC NameN-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine
SMILESCCNC(Cc1c(C)cc(C)cc1C)C1CCC(C)CC1
InChIInChI=1S/C20H33N/c1-6-21-20(18-9-7-14(2)8-10-18)13-19-16(4)11-15(3)12-17(19)5/h11-12,14,18,20-21H,6-10,13H2,1-5H3
InChIKeyOQGOZRKSTZKWTF-UHFFFAOYSA-N
XLogP4.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.49
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine (CID 63415653) is N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine is CCNC(Cc1c(C)cc(C)cc1C)C1CCC(C)CC1.
What is the InChIKey of N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine?
The InChIKey is OQGOZRKSTZKWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N/c1-6-21-20(18-9-7-14(2)8-10-18)13-19-16(4)11-15(3)12-17(19)5/h11-12,14,18,20-21H,6-10,13H2,1-5H3.
What are the key properties of N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine?
N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine has a molecular weight of 287.49 g/mol, XLogP of 4.96, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methylcyclohexyl)-2-(2,4,6-trimethylphenyl)ethanamine is sourced from PubChem (CID 63415653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).