2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine

C19H26N2 — CID 105174594

IUPAC2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine
SMILESCCNC(Cc1c(C)cccc1C)c1ccc(C)nc1C
InChIInChI=1S/C19H26N2/c1-6-20-19(17-11-10-15(4)21-16(17)5)12-18-13(2)8-7-9-14(18)3/h7-11,19-20H,6,12H2,1-5H3
InChIKeyHMRXKIQULUSEDX-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.21
Rot. Bonds5

About 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine

2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine (PubChem CID 105174594) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine.

Molecular Properties

Compound Name2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine
PubChem CID105174594
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine
SMILESCCNC(Cc1c(C)cccc1C)c1ccc(C)nc1C
InChIInChI=1S/C19H26N2/c1-6-20-19(17-11-10-15(4)21-16(17)5)12-18-13(2)8-7-9-14(18)3/h7-11,19-20H,6,12H2,1-5H3
InChIKeyHMRXKIQULUSEDX-UHFFFAOYSA-N
XLogP4.21
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine?
The IUPAC name of 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine (CID 105174594) is 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine.
What is the SMILES notation for 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine?
The canonical SMILES for 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine is CCNC(Cc1c(C)cccc1C)c1ccc(C)nc1C.
What is the InChIKey of 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine?
The InChIKey is HMRXKIQULUSEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-6-20-19(17-11-10-15(4)21-16(17)5)12-18-13(2)8-7-9-14(18)3/h7-11,19-20H,6,12H2,1-5H3.
What are the key properties of 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine?
2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine has a molecular weight of 282.43 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine is sourced from PubChem (CID 105174594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).