N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine

C17H22N2 — CID 116824934

IUPACN-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine
SMILESCNCC(c1ccncc1)c1cc(C)c(C)cc1C
InChIInChI=1S/C17H22N2/c1-12-9-14(3)16(10-13(12)2)17(11-18-4)15-5-7-19-8-6-15/h5-10,17-18H,11H2,1-4H3
InChIKeyWGJFCYPFAPKAKJ-UHFFFAOYSA-N
MW254.38 g/mol
LogP3.36
Rot. Bonds4

About N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine

N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine (PubChem CID 116824934) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine
PubChem CID116824934
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine
SMILESCNCC(c1ccncc1)c1cc(C)c(C)cc1C
InChIInChI=1S/C17H22N2/c1-12-9-14(3)16(10-13(12)2)17(11-18-4)15-5-7-19-8-6-15/h5-10,17-18H,11H2,1-4H3
InChIKeyWGJFCYPFAPKAKJ-UHFFFAOYSA-N
XLogP3.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2,2-dipyridin-4-ylethanamine
CID 116824958
2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 116824907
2-(5-bromo-2-fluorophenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 116824951
[pyridin-4-yl-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105196567
N-methyl-2-pyridin-4-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 116824902
N-[pyridin-4-yl-(2,4,5-trimethylphenyl)methyl]propan-1-amine
CID 64989997
2-fluoro-N-methyl-2-pyridin-4-ylethanamine
CID 83853523
N,3-dimethyl-2-(2,4,5-trimethylphenyl)butan-1-amine
CID 116964332
3-(methylamino)-2-(2,4,5-trimethylphenyl)propan-1-ol
CID 116835502
3-(methylamino)-2-pyridin-4-ylpropan-1-ol
CID 117246508
N-methyl-1-(4-methyl-3-pyridinyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 114878144
N-methyl-2-pyridin-4-ylpentan-1-amine
CID 116824893

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine?
The IUPAC name of N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine (CID 116824934) is N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine.
What is the SMILES notation for N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine?
The canonical SMILES for N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine is CNCC(c1ccncc1)c1cc(C)c(C)cc1C.
What is the InChIKey of N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine?
The InChIKey is WGJFCYPFAPKAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-12-9-14(3)16(10-13(12)2)17(11-18-4)15-5-7-19-8-6-15/h5-10,17-18H,11H2,1-4H3.
What are the key properties of N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine?
N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine has a molecular weight of 254.38 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine is sourced from PubChem (CID 116824934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).