2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

C17H22N2 — CID 105101832

IUPAC2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCc1ccc(CC(NC)c2cncc(C)c2)cc1
InChIInChI=1S/C17H22N2/c1-4-14-5-7-15(8-6-14)10-17(18-3)16-9-13(2)11-19-12-16/h5-9,11-12,17-18H,4,10H2,1-3H3
InChIKeyGHUHAWHYWOWSIV-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.46
Rot. Bonds5

About 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 105101832) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
PubChem CID105101832
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCCc1ccc(CC(NC)c2cncc(C)c2)cc1
InChIInChI=1S/C17H22N2/c1-4-14-5-7-15(8-6-14)10-17(18-3)16-9-13(2)11-19-12-16/h5-9,11-12,17-18H,4,10H2,1-3H3
InChIKeyGHUHAWHYWOWSIV-UHFFFAOYSA-N
XLogP3.46
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(5-methyl-3-pyridinyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 105137056
2-(3,4-dimethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 115374488
2-(3-fluorophenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 113297174
N-methyl-1-(5-methyl-3-pyridinyl)-2-pyridin-3-ylethanamine
CID 113297193
2-(3-chloro-4-fluorophenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 103043135
(4-ethylphenyl)-(5-methyl-3-pyridinyl)methanol
CID 115373656
N-[2-(4-fluorophenyl)-1-(5-methyl-3-pyridinyl)ethyl]propan-1-amine
CID 115374313
2-(3-bromo-5-fluorophenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 105169477
N-methyl-1-(5-methyl-3-pyridinyl)-2-thiophen-2-ylethanamine
CID 115374448
2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 105161681
2-(2-bromo-4-fluorophenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 105136403
2-ethoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 115374703

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (CID 105101832) is 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is CCc1ccc(CC(NC)c2cncc(C)c2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is GHUHAWHYWOWSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-4-14-5-7-15(8-6-14)10-17(18-3)16-9-13(2)11-19-12-16/h5-9,11-12,17-18H,4,10H2,1-3H3.
What are the key properties of 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 105101832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).