N-benzyl-N-methyl-2-pyridin-4-ylethanamine

C15H18N2 — CID 78793254

IUPACN-benzyl-N-methyl-2-pyridin-4-ylethanamine
SMILESCN(CCc1ccncc1)Cc1ccccc1
InChIInChI=1S/C15H18N2/c1-17(13-15-5-3-2-4-6-15)12-9-14-7-10-16-11-8-14/h2-8,10-11H,9,12-13H2,1H3
InChIKeyMTYJLIDWJTYLEB-UHFFFAOYSA-N
MW226.32 g/mol
LogP2.76
Rot. Bonds5

About N-benzyl-N-methyl-2-pyridin-4-ylethanamine

N-benzyl-N-methyl-2-pyridin-4-ylethanamine (PubChem CID 78793254) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-pyridin-4-ylethanamine
PubChem CID78793254
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-benzyl-N-methyl-2-pyridin-4-ylethanamine
SMILESCN(CCc1ccncc1)Cc1ccccc1
InChIInChI=1S/C15H18N2/c1-17(13-15-5-3-2-4-6-15)12-9-14-7-10-16-11-8-14/h2-8,10-11H,9,12-13H2,1H3
InChIKeyMTYJLIDWJTYLEB-UHFFFAOYSA-N
XLogP2.76
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841
N-[(4-iodophenyl)methyl]-N-methyl-2-pyridin-4-ylethanamine
CID 65478370
N'-benzyl-N,N'-dimethyl-N-(2-pyridin-4-ylethyl)oxamide
CID 108984872
N-[[2-(aminomethyl)phenyl]methyl]-N-methyl-2-pyridin-4-ylethanamine
CID 54945558
N-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]-2-pyridin-4-ylethanamine
CID 75504441
N-benzyl-N,N',2,2-tetramethyl-N'-(2-pyridin-4-ylethyl)propanediamide
CID 108962257
2-[benzyl(2-pyridin-4-ylethyl)amino]ethanol
CID 60649363
N-methyl-N-[(2-propan-2-ylpyrimidin-5-yl)methyl]-2-pyridin-4-ylethanamine
CID 74231773
N-(2-bromoethyl)-N-methyl-2-pyridin-4-ylethanamine
CID 61286935
2-N-benzyl-2-N,4-N-dimethyl-4-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112890972
N-benzyl-2-(1H-imidazol-2-yl)-N-methylethanamine
CID 91213426
N-methyl-N-[[3-(2-phenylethyl)-1H-1,2,4-triazol-5-yl]methyl]-1-pyridin-4-ylmethanamine
CID 50951240

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-pyridin-4-ylethanamine?
The IUPAC name of N-benzyl-N-methyl-2-pyridin-4-ylethanamine (CID 78793254) is N-benzyl-N-methyl-2-pyridin-4-ylethanamine.
What is the SMILES notation for N-benzyl-N-methyl-2-pyridin-4-ylethanamine?
The canonical SMILES for N-benzyl-N-methyl-2-pyridin-4-ylethanamine is CN(CCc1ccncc1)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-2-pyridin-4-ylethanamine?
The InChIKey is MTYJLIDWJTYLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-17(13-15-5-3-2-4-6-15)12-9-14-7-10-16-11-8-14/h2-8,10-11H,9,12-13H2,1H3.
What are the key properties of N-benzyl-N-methyl-2-pyridin-4-ylethanamine?
N-benzyl-N-methyl-2-pyridin-4-ylethanamine has a molecular weight of 226.32 g/mol, XLogP of 2.76, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 78793254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).