2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline

C15H18N2 — CID 43189781

IUPAC2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline
SMILESCc1ccc(NC(C)c2ccncc2)c(C)c1
InChIInChI=1S/C15H18N2/c1-11-4-5-15(12(2)10-11)17-13(3)14-6-8-16-9-7-14/h4-10,13,17H,1-3H3
InChIKeyUKLIQITYXPHDRI-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.87
Rot. Bonds3

About 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline

2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline (PubChem CID 43189781) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline.

Molecular Properties

Compound Name2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline
PubChem CID43189781
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline
SMILESCc1ccc(NC(C)c2ccncc2)c(C)c1
InChIInChI=1S/C15H18N2/c1-11-4-5-15(12(2)10-11)17-13(3)14-6-8-16-9-7-14/h4-10,13,17H,1-3H3
InChIKeyUKLIQITYXPHDRI-UHFFFAOYSA-N
XLogP3.87
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-2,4-dimethylaniline
CID 43078754
N-[1-(4-bromophenyl)ethyl]-2,4-dimethylaniline
CID 43105030
1-(2,4-dimethylphenyl)-3-[(1R)-1-pyridin-4-ylethyl]urea
CID 40637085
4-methyl-N-(1-pyridin-4-ylethyl)pyridin-3-amine
CID 63329623
2,4-dimethyl-N-[1-(2,4,5-trimethylphenyl)ethyl]aniline
CID 43104045
2,5-dichloro-4-methyl-N-(1-pyridin-4-ylethyl)aniline
CID 104726127
(1R)-N-[(2,4-dimethylphenyl)methyl]-1-pyridin-4-ylethanamine
CID 28643694
2,4-dichloro-N-(1-pyridin-4-ylethyl)aniline
CID 43192035
N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 43672879
2,4-dimethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]aniline
CID 106756779
2,4,5-trichloro-N-(1-pyridin-4-ylethyl)aniline
CID 43096623
4-chloro-2-methyl-N-[1-(4-propan-2-ylphenyl)ethyl]aniline
CID 43101529

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline?
The IUPAC name of 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline (CID 43189781) is 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline.
What is the SMILES notation for 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline?
The canonical SMILES for 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline is Cc1ccc(NC(C)c2ccncc2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline?
The InChIKey is UKLIQITYXPHDRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-11-4-5-15(12(2)10-11)17-13(3)14-6-8-16-9-7-14/h4-10,13,17H,1-3H3.
What are the key properties of 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline?
2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline has a molecular weight of 226.32 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(1-pyridin-4-ylethyl)aniline is sourced from PubChem (CID 43189781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).