N-(2-ethylcyclohexyl)-3,5-dimethylaniline

C16H25N — CID 63863762

IUPACN-(2-ethylcyclohexyl)-3,5-dimethylaniline
SMILESCCC1CCCCC1Nc1cc(C)cc(C)c1
InChIInChI=1S/C16H25N/c1-4-14-7-5-6-8-16(14)17-15-10-12(2)9-13(3)11-15/h9-11,14,16-17H,4-8H2,1-3H3
InChIKeyXOERPJACEIPENX-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.68
Rot. Bonds3

About N-(2-ethylcyclohexyl)-3,5-dimethylaniline

N-(2-ethylcyclohexyl)-3,5-dimethylaniline (PubChem CID 63863762) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-(2-ethylcyclohexyl)-3,5-dimethylaniline.

Molecular Properties

Compound NameN-(2-ethylcyclohexyl)-3,5-dimethylaniline
PubChem CID63863762
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-(2-ethylcyclohexyl)-3,5-dimethylaniline
SMILESCCC1CCCCC1Nc1cc(C)cc(C)c1
InChIInChI=1S/C16H25N/c1-4-14-7-5-6-8-16(14)17-15-10-12(2)9-13(3)11-15/h9-11,14,16-17H,4-8H2,1-3H3
InChIKeyXOERPJACEIPENX-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclohexyl)-3,5-dimethylaniline?
The IUPAC name of N-(2-ethylcyclohexyl)-3,5-dimethylaniline (CID 63863762) is N-(2-ethylcyclohexyl)-3,5-dimethylaniline.
What is the SMILES notation for N-(2-ethylcyclohexyl)-3,5-dimethylaniline?
The canonical SMILES for N-(2-ethylcyclohexyl)-3,5-dimethylaniline is CCC1CCCCC1Nc1cc(C)cc(C)c1.
What is the InChIKey of N-(2-ethylcyclohexyl)-3,5-dimethylaniline?
The InChIKey is XOERPJACEIPENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-4-14-7-5-6-8-16(14)17-15-10-12(2)9-13(3)11-15/h9-11,14,16-17H,4-8H2,1-3H3.
What are the key properties of N-(2-ethylcyclohexyl)-3,5-dimethylaniline?
N-(2-ethylcyclohexyl)-3,5-dimethylaniline has a molecular weight of 231.38 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclohexyl)-3,5-dimethylaniline is sourced from PubChem (CID 63863762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).